SCHEMBL714835

SCHEMBL714835

COc1cc(C(C)N)ccc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.62
BLM P54132 2/20 0.60
PMP22 Q01453 1/20 0.60
TSHR P16473 3/20 0.59
CYP3A4 P08684 1/20 0.59
NPSR1 Q6W5P4 1/20 0.57
SLC22A3 O75751 1/20 0.55
MAOB P27338 1/20 0.53
FOS P01100 1/20 0.51
TTR P02766 1/20 0.51
JUN P05412 1/20 0.51
NR3C1 P04150 1/20 0.51
HSD17B1 P14061 1/20 0.51
HSD17B2 P37059 1/20 0.51
BCHE P06276 2/20 0.51
TYR P14679 2/20 0.51
ACHE P22303 2/20 0.51
GAA P10253 1/20 0.51
ALDH1A1 P00352 1/20 0.50
CYP19A1 P11511 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1753786 1.00 NFKB1 (0.62) NFKB1BLMPMP22TSHRCYP3A4
Hydrochloric Acid SCHEMBL2108926 0.98 BLM (0.63) NFKB1BLMPMP22TSHRCYP3A4
Hydrochloric Acid SCHEMBL2108923 0.98 BLM (0.63) NFKB1BLMPMP22TSHRCYP3A4
SCHEMBL3140349 0.85 TUBB4A (0.56) NFKB1BLMPMP22TSHRCYP3A4
SCHEMBL21852873 0.84 TSHR (0.62) NFKB1BLMPMP22TSHRCYP3A4
SCHEMBL29625307 0.84 TSHR (0.62) NFKB1BLMPMP22TSHRCYP3A4
SCHEMBL2411502 0.84 TSHR (0.62) NFKB1BLMPMP22TSHRCYP3A4
SCHEMBL14609575 0.83 NFKB1 (0.60) NFKB1BLMPMP22TSHRCYP3A4
Methylamine SCHEMBL4826800 0.83 NFKB1 (0.65) NFKB1BLMPMP22TSHRCYP3A4
Hydrochloric Acid SCHEMBL3563549 0.83 TUBB4A (0.54) NFKB1BLMPMP22TSHRCYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120192666-A Bio-based silica gel material and preparation method thereof 广东彩汇美新材料技术有限公司 2025-06-24 CN claimed
US-20120186998-A1 Microelectrode, Microelectrode formation, and methods of utilizing microelectrodes for charaterizing properties of localized environments and substrates NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-07-26 US claimed
WO-2008039320-A1 MICROELECTRODES, MICROELECTRODE FORMATION, AND METHODS OF UTILIZING MICROELCTRODES FOR CHARACTERIZING PROPERTIES OF LOCALIZED ENVIRONMENTS AND SUBSTRATES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-04-03 WO claimed
US-4076537-A Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US claimed
CN-120192666-A Bio-based silica gel material and preparation method thereof 广东彩汇美新材料技术有限公司 2025-06-24 CN disclosed
CN-120192666-A Bio-based silica gel material and preparation method thereof 广东彩汇美新材料技术有限公司 2025-06-24 CN disclosed
CN-111116375-B Method for preparing primary amine by catalyzing aldehyde ketone compound through reductive amination 中国科学院广州能源研究所 2023-04-07 CN disclosed
EP-2848617-B1 DIARYL[A, G]QUINOLIZIDINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF SHANGHAI INST MATERIA MEDICA CAS (CN) 2022-01-12 EP disclosed
CN-111116375-A Method for preparing primary amine by catalyzing aldehyde ketone compound through reductive amination 中国科学院广州能源研究所 2020-05-08 CN disclosed
US-10308588-B2 Synthesis of amides and amines from aldehydes or ketones by heterogeneous metal catalysis ORGANOFUEL SWEDEN AB (SE) 2019-06-04 US disclosed
US-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2019-01-08 US disclosed
US-20170362162-A1 SYNTHESIS OF AMIDES AND AMINES FROM ALDEHYDES OR KETONES BY HETEROGENEOUS METAL CATALYSIS ORGANOFUEL SWEDEN AB (SE) 2017-12-21 US disclosed
US-20100087480-A1 SUBSTITUTED PHENYLMETHYL BICYCLOCARBOXYAMIDE COMPOUNDS PFIZER INC. 2010-04-08 US disclosed
WO-2008039320-A1 MICROELECTRODES, MICROELECTRODE FORMATION, AND METHODS OF UTILIZING MICROELCTRODES FOR CHARACTERIZING PROPERTIES OF LOCALIZED ENVIRONMENTS AND SUBSTRATES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-04-03 WO disclosed
EP-0091385-A1 Process for the preparation of p-hydroxybenzyl nitriles or p-hydroxybenzyl amines RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1983-10-12 EP disclosed
US-4191765-A 1-Aryloxy-2-hydroxy-3-aminopropanes HOECHST AKTIENGESELLSCHAFT (DE) 1980-03-04 US disclosed
US-4076537-A Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US disclosed
US-4076530-A Dry photographic copying method for producing Te images FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US disclosed
US-4062685-A ORGANO-TELLURIUM COMPOUND FUJI PHOTO FILM CO., LTD. (JA) 1977-12-13 US disclosed
US-3983151-A Process for the preparation of 4-hydroxy-3-methoxy-phenylacetonitrile BAYER AKTIENGESELLSCHAFT (DT) 1976-09-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100087480-A1 SUBSTITUTED PHENYLMETHYL BICYCLOCARBOXYAMIDE COMPOUNDS TRPV1, P2RY1, TRPV2 NFKB1 1356/4885BLM 4562/4885PMP22 226/4885
US-20170362162-A1 SYNTHESIS OF AMIDES AND AMINES FROM ALDEHYDES OR KETONES BY HETEROGENEOUS METAL CATALYSIS DCXR, ADH5, CBR1 NFKB1 2492/4885BLM 4878/4885PMP22 2823/4885
US-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof ADORA2A, ADORA3, ADORA1 NFKB1 3506/4885BLM 2005/4885PMP22 3405/4885
US-10308588-B2 Synthesis of amides and amines from aldehydes or ketones by heterogeneous metal catalysis DCXR, ADH5, CBR1 NFKB1 2492/4885BLM 4878/4885PMP22 2823/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.