SCHEMBL109882

SCHEMBL109882

O=C(O)c1ccccc1N1CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 3/20 0.55
HTR6 P50406 6/20 0.54
HTR1A P08908 5/20 0.54
HTR2A P28223 2/20 0.54
HTR7 P34969 2/20 0.54
HTR5A P47898 2/20 0.54
HTR3A P46098 4/20 0.50
ALDH1A1 P00352 2/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 2/20 0.50
HTR3E A5X5Y0 2/20 0.50
HTR3B O95264 2/20 0.50
HTR3D Q70Z44 2/20 0.50
HTR3C Q8WXA8 2/20 0.50
SIGMAR1 Q99720 2/20 0.50
ABCC1 P33527 1/20 0.50
ALOX15 P16050 1/20 0.50
USP2 O75604 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50

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
Sulfuric Acid SCHEMBL2384874 0.94 HTR6 (0.54) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL5707829 0.87 ADRB1 (0.56) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL8048603 0.87 ALDH1A1 (0.61) ALDH1A1TSHRALOX15USP2NPC1
SCHEMBL3407551 0.85 HTR6 (0.66) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL1450313 0.84 NPC1 (0.70) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL4458672 0.84 ADRB1 (0.56) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL31349267 0.84 ADRB1 (0.56) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL20516446 0.83 ADRB1 (0.61) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL29835980 0.83 TTR (0.57) ADRB1HTR6HTR1AHTR2AHTR7
SCHEMBL26968308 0.83 TTR (0.57) ADRB1HTR6HTR1AHTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661473-A Method for synthesizing beta-sulfur trifluoromethyl alkylamine by olefin difunctional reaction 东北师范大学 2025-03-21 CN claimed
US-20240199679-A1 ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME FUTURE MEDICINE CO., LTD. (KR) 2024-06-20 US claimed
EP-4296273-A1 ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME Future Medicine Co., Ltd. (KR) 2023-12-27 EP claimed
CN-117083286-A Pair A 2A A is a 3 Adenosine derivatives having antagonism to adenosine receptor and process for preparing same 未来制药有限公司 2023-11-17 CN claimed
WO-2022203427-A1 ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME 퓨쳐메디신 주식회사 2022-09-29 WO claimed
US-8211914-B2 Inhibitors of diacylglycerol acyltransferase MADRIGAL PHARMACEUTICALS, INC. (US) 2012-07-03 US claimed
CN-102245024-A Inhibitors of diacylglycerol aclytransferase VIA PHARMACEUTICALS INC 2011-11-16 CN claimed
EP-2378878-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE Via Pharmaceuticals, Inc. (US) 2011-10-26 EP claimed
WO-2010077861-A1 INHIBITORS OF DIACYLGLYCEROL ACLYTRANSFERASE VIA PHARMACEUTICALS, INC (US) 2010-07-08 WO claimed
US-20100152445-A1 Inhibitors of Diacylglycerol Acyltransferase MADRIGAL PHARMACEUTICALS, INC. 2010-06-17 US claimed
EP-2081917-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF Abbott Laboratories (US) 2009-07-29 EP claimed
WO-2008027932-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2008-03-06 WO claimed
US-12365659-B2 Non-polyamine based polyamine transport inhibitors and their use in the treatment of human cancers UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2025-07-22 US disclosed
CN-119661473-A Method for synthesizing beta-sulfur trifluoromethyl alkylamine by olefin difunctional reaction 东北师范大学 2025-03-21 CN disclosed
US-20240199679-A1 ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME FUTURE MEDICINE CO., LTD. (KR) 2024-06-20 US disclosed
US-20240166614-A1 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2024-05-23 US disclosed
US-5849912-A Biphenyl derivatives EISAI CO., LTD. (JP) 1998-12-15 US disclosed
WO-1998000144-A1 FIBRINOGEN RECEPTOR ANTAGONIST PRODRUGS MERCK & CO., INC. (US) 1998-01-08 WO disclosed
WO-1998000401-A1 FIBRINOGEN RECEPTOR ANTAGONIST PRODRUGS MERCK & CO., INC. (US) 1998-01-08 WO disclosed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP 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-20100152445-A1 Inhibitors of Diacylglycerol Acyltransferase DGAT2, DGAT1, ACAT2 ADRB1 2051/4885HTR6 3344/4885HTR1A 3881/4885
US-12365659-B2 Non-polyamine based polyamine transport inhibitors and their use in the treatment of human cancers SLC19A1, PNMT, SRM ADRB1 3906/4885HTR6 947/4885HTR1A 1265/4885
US-20240199679-A1 ADENOSINE DERIVATIVE HAVING ANTAGONISTIC ACTION ON A2A AND A3 ADENOSINE RECEPTORS AND METHOD FOR PREPARING SAME ADORA2A, ADORA3, ADORA2B ADRB1 39/4885HTR6 55/4885HTR1A 18/4885
US-20240166614-A1 NON-POLYAMINE BASED POLYAMINE TRANSPORT INHIBITORS AND THEIR USE IN THE TREATMENT OF HUMAN CANCERS SLC19A1, PNMT, SRM ADRB1 3906/4885HTR6 947/4885HTR1A 1265/4885

“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.