SCHEMBL101511

SCHEMBL101511

CC1=Nc2ccc(C)cc2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.41
RAB9A P51151 3/20 0.41
CASP3 P42574 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MDM2 Q00987 1/20 0.40
HTT P42858 3/20 0.38
GAA P10253 1/20 0.38
THRB P10828 2/20 0.36
MAPT P10636 2/20 0.36

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
SCHEMBL38660687 1.00 TDP1 (0.41) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL5695447 0.89 TDP1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL5850640 0.85 MEN1 (0.37) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL10111633 0.83 TDP1 (0.41) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL31142510 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL317019 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL3418732 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL665154 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL10035871 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1
SCHEMBL661200 0.80 MEN1 (0.39) TDP1RAB9ACASP3ATMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118126048-A Preparation and application methods of cuporphyrin cyanine nano particles with switchable photodynamic and photothermal effects and chemical dynamic effects 北京化工大学 2024-06-04 CN claimed
CN-118126048-A Preparation and application methods of cuporphyrin cyanine nano particles with switchable photodynamic and photothermal effects and chemical dynamic effects 北京化工大学 2024-06-04 CN disclosed
WO-2024023138-A2 CA-IX TARGETING FLUORESCENT PROBES BRACCO IMAGING SPA (IT) 2024-02-01 WO disclosed
CN-117447636-A Photo/mechanochromatic material and preparation method and application thereof 中国科学技术大学 2024-01-26 CN disclosed
US-20230382857-A1 HEPTAMETHINE CYANINES FOR USE AS FLUORESCENT MARKERS OF THE BILIARY AND RENAL SYSTEMS CHILDREN'S NATIONAL MEDICAL CENTER (US) 2023-11-30 US disclosed
US-11787764-B2 Heptamethine cyanines for use as fluorescent markers of the biliary and renal systems CHILDREN'S NATIONAL MEDICAL CENTER (US) 2023-10-17 US disclosed
US-11746086-B2 Non-aggregating heptamethine cyanine fluorophores for in vivo imaging THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-09-05 US disclosed
US-11707537-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-07-25 US disclosed
WO-2023011656-A1 FLUORESCENT DYE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 纳莹(上海)生物科技有限公司 2023-02-09 WO disclosed
US-20220267330-A1 NEAR-INFRARED FLUORESCENT MOLECULE ACTIVE TARGETING FOLATE RECEPTOR AND PREPARATION METHOD THEREOF NANJING NUOYUAN MEDICAL DEVICES CO., LTD (CN) 2022-08-25 US disclosed
EP-0446731-A2 Process for the manufacture of azo dyes BAYER AG (DE) 1991-09-18 EP disclosed
EP-0023671-B1 PROCESS FOR THE PREPARATION OF CATIONIC DYESTUFFS BAYER AG (DE) 1982-02-03 EP disclosed
US-4314058-A Indolins styryl-like compounds MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1982-02-02 US disclosed
US-4281112-A Process for the preparation of cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1981-07-28 US disclosed
EP-0023671-A1 Process for the preparation of cationic dyestuffs BAYER AG (DE) 1981-02-11 EP disclosed
US-4147862-A Method of preparing styryl-like compounds MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1979-04-03 US disclosed
US-4139274-A Apparatus for changing color MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1979-02-13 US disclosed
US-4110070-A QUATERNIZING INDOLENINE METHINE COMPOUND ON FIBERS TO FORM CATIONIC DYE HODOGAYA CHEMICAL CO., LTD. (JP) 1978-08-29 US disclosed
US-4007172-A STYRYL DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-02-08 US disclosed
US-3975379-A METHINE BAYER AKTIENGESELLSCHAFT (DT) 1976-08-17 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 (5 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-11787764-B2 Heptamethine cyanines for use as fluorescent markers of the biliary and renal systems CD68, PAX2, PYGL TDP1 3767/4885RAB9A 2403/4885CASP3 1244/4885
US-11746086-B2 Non-aggregating heptamethine cyanine fluorophores for in vivo imaging CNDP2, MSN, CHAT TDP1 1473/4885RAB9A 1172/4885CASP3 390/4885
US-20230382857-A1 HEPTAMETHINE CYANINES FOR USE AS FLUORESCENT MARKERS OF THE BILIARY AND RENAL SYSTEMS CD68, HCCS, NR1H4 TDP1 3471/4885RAB9A 2334/4885CASP3 1215/4885
US-20220267330-A1 NEAR-INFRARED FLUORESCENT MOLECULE ACTIVE TARGETING FOLATE RECEPTOR AND PREPARATION METHOD THEREOF FOLR1, FOLR2, DHFR TDP1 2842/4885RAB9A 539/4885CASP3 1026/4885
US-11707537-B2 Conformational restriction of cyanine fluorophores in far-red and near-IR range IK, FAR1, SPR TDP1 1492/4885RAB9A 782/4885CASP3 1354/4885

“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.