SCHEMBL1914606

SCHEMBL1914606

c1ccc(-c2cccc(N3CCNCC3)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 1.00
HTR1A P08908 8/20 1.00
TP53 P04637 4/20 0.71
CYP1A2 P05177 4/20 0.71
CYP2D6 P10635 4/20 0.71
USP2 O75604 3/20 0.71
ALDH1A1 P00352 3/20 0.71
HSD17B10 Q99714 3/20 0.71
CYP3A4 P08684 3/20 0.71
MAPK1 P28482 2/20 0.71
TSHR P16473 1/20 0.71
ADRB1 P08588 3/20 0.68
HTR3E A5X5Y0 2/20 0.68
HTR3B O95264 2/20 0.68
HTR3A P46098 2/20 0.68
HTR3D Q70Z44 2/20 0.68
HTR3C Q8WXA8 2/20 0.68
SIGMAR1 Q99720 2/20 0.68
HIF1A Q16665 1/20 0.64
HTR2C P28335 2/20 0.63

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
SCHEMBL30022113 1.00 HTR7 (1.00) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL30146627 0.98 HTR7 (0.96) HTR7HTR1ATP53CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL29157433 0.98 HTR7 (0.96) HTR7HTR1ATP53CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL6786785 0.98 HTR7 (0.96) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL13118661 0.86 HTR7 (0.76) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL15577989 0.86 HTR7 (1.00) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL15538190 0.86 HTR7 (0.75) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL13118660 0.84 HTR7 (0.81) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL1359864 0.82 ADRB1 (0.76) HTR7HTR1ATP53CYP1A2CYP2D6
SCHEMBL27497441 0.82 HTR1A (0.70) HTR7HTR1ATP53CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250026749-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2025-01-23 US disclosed
US-12060349-B2 Glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2024-08-13 US disclosed
US-20240124400-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME DUKE UNIVERSITY (US) 2024-04-18 US disclosed
CN-113272292-B (2, 5-dioxopyrrolidin-1-yl) (phenyl) -acetamide derivatives and their use in the treatment of neurological diseases 雅盖隆大学 2024-04-12 CN disclosed
CN-117586179-A GPR183 antagonist and synthetic method and application thereof 中国人民解放军海军特色医学中心 2024-02-23 CN disclosed
US-20230121721-A1 MONOACYLGLYCEROL LIPASE INHIBITORS STICHTING HET NEDERLANDS KANKER INST ANTONI VAN LEEUWENHOEK ZIEKENHUIS (NL) 2023-04-20 US disclosed
US-20230121721-A1 MONOACYLGLYCEROL LIPASE INHIBITORS STICHTING HET NEDERLANDS KANKER INST ANTONI VAN LEEUWENHOEK ZIEKENHUIS (NL) 2023-04-20 US disclosed
US-11530198-B2 Compositions and methods for treating infections Vyera Pharmaceuticals, LLC (US) 2022-12-20 US disclosed
US-11530198-B2 Compositions and methods for treating infections Vyera Pharmaceuticals, LLC (US) 2022-12-20 US disclosed
EP-4098654-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Genzyme Corporation (US) 2022-12-07 EP disclosed
US-20070232610-A1 Novel compounds that are ERK inhibitors SCHERING CORPORATION 2007-10-04 US disclosed
WO-2007097937-A1 PYRROLIDINE DERIVATIVES AS ERK INHIBITORS SCHERING CORPORATION (US) 2007-08-30 WO disclosed
EP-1590329-A1 N-ARYL HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF Aventis Pharma S.A. (FR) 2005-11-02 EP disclosed
US-20050130989-A1 N-arylheteroaromatic products compositions containing them and use thereof AVENTIS PHARMA S. A. (FR) 2005-06-16 US disclosed
WO-2004078732-A1 N-ARYL HETEROAROMATIC PRODUCTS, COMPOSITIONS CONTAINING SAME AND USE THEREOF AVENTIS PHARMA S.A. (FR) 2004-09-16 WO disclosed
EP-0931067-B1 D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2002-06-26 EP disclosed
US-6258813-B1 BIOLOGICAL RECEPTORS WITH TETRAHYDROPIPERIZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT (DE) 2001-07-10 US disclosed
EP-0931067-A1 D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES MERCK PATENT GmbH (DE) 1999-07-28 EP disclosed
WO-1998011068-A1 D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES MERCK PATENT GMBH (DE) 1998-03-19 WO disclosed
US-4831034-A 4-benzylpiperazines useful as neuroleptics RHONE-POULENC SANTE (FR) 1989-05-16 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 (7 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-20230121721-A1 MONOACYLGLYCEROL LIPASE INHIBITORS MGLL, PNLIP, LIPA HTR7 3241/4885HTR1A 3924/4885TP53 4565/4885
US-20240124400-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME CFH, LPAR3, CBR3 HTR7 2576/4885HTR1A 3731/4885TP53 2811/4885
US-12060349-B2 Glucosylceramide synthase inhibitors GBA1, GBA2, GALC HTR7 4806/4885HTR1A 4682/4885TP53 2252/4885
US-20250026749-A1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA HTR7 4826/4885HTR1A 4709/4885TP53 1678/4885
US-20050130989-A1 N-arylheteroaromatic products compositions containing them and use thereof AHR, NQO1, ARNT HTR7 1802/4885HTR1A 2645/4885TP53 79/4885
US-20070232610-A1 Novel compounds that are ERK inhibitors MAPK1, MAPK4, MAPKAPK2 HTR7 4142/4885HTR1A 3787/4885TP53 120/4885
US-11530198-B2 Compositions and methods for treating infections DHFR, DHODH, QDPR HTR7 4280/4885HTR1A 4572/4885TP53 3555/4885

“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.