SCHEMBL131842

SCHEMBL131842

NCc1ccc(-c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 6/20 1.00
▸ HRH3 Q9Y5N1 1/20 0.78
▸ LOXL2 Q9Y4K0 2/20 0.68
▸ CYP2A6 P11509 1/20 0.59
▸ IDO1 P14902 2/20 0.56
▸ AGXT P21549 2/20 0.56
▸ ADRB2 P07550 1/20 0.54
▸ LTA4H P09960 1/20 0.52
▸ CSNK2A1 P68400 2/20 0.52
▸ ABCC4 O15439 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ CHRNB2 P17787 1/20 0.50
▸ CHRNA4 P43681 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ HSD17B10 Q99714 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
SCHEMBL22202237 1.00 TAAR1 (1.00) TAAR1HRH3LOXL2CYP2A6IDO1
SCHEMBL28208288 1.00 TAAR1 (1.00) TAAR1HRH3LOXL2CYP2A6IDO1
SCHEMBL22291708 1.00 TAAR1 (1.00) TAAR1HRH3LOXL2CYP2A6IDO1
Hydrochloric Acid SCHEMBL1661202 0.97 TAAR1 (0.95) TAAR1HRH3LOXL2CYP2A6IDO1
Hydrochloric Acid SCHEMBL7921699 0.97 TAAR1 (0.95) TAAR1HRH3LOXL2CYP2A6IDO1
SCHEMBL28164006 0.93 TAAR1 (0.86) TAAR1HRH3LOXL2CYP2A6IDO1
Biphenyl SCHEMBL27410798 0.92 TAAR1 (0.84) TAAR1HRH3LOXL2CYP2A6IDO1
SCHEMBL2274647 0.88 HRH3 (1.00) TAAR1HRH3LOXL2CYP2A6ADRB2
SCHEMBL5362598 0.87 TAAR1 (0.77) TAAR1HRH3LOXL2CYP2A6IDO1
SCHEMBL22462436 0.87 TAAR1 (0.75) TAAR1HRH3LOXL2CYP2A6IDO1

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 1157 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122081969-A VSe-Cu2-xSe nanosheet catalysis C (sp)3) -H bond CO2Method for directionally synthesizing alpha-hydroxy/amino acid by carboxylation — 2026-05-26 — — CN claimed
CN-115874288-B Preparation method of zinc-based organic metal halide long afterglow material monocrystal and powder 首都师范大学 2026-05-19 — — CN claimed
CN-118634745-B Preparation method of microcapsule embedded with probiotics 绍兴同创生物科技有限公司 2025-03-18 — — CN claimed
CN-117596783-B High-frequency carbon-hydrogen copper-clad plate and preparation method thereof 江苏耀鸿电子有限公司 2024-10-01 — — CN claimed
CN-118634745-A Preparation method of microcapsule embedded with probiotics 绍兴同创生物科技有限公司 2024-09-13 — — CN claimed
CN-118027102-A Ruthenium complex with enaminone structure, and preparation method and application thereof 中国科学院理化技术研究所 2024-05-14 — — CN claimed
CN-117596783-A High-frequency carbon-hydrogen copper-clad plate and preparation method thereof 江苏耀鸿电子有限公司 2024-02-23 — — CN claimed
CN-115874288-A Preparation method of zinc-based organic metal halide long afterglow material single crystal and powder 首都师范大学 2023-03-31 — — CN claimed
CN-108329225-B P-dibenzoyl dimer derivative and synthetic method and application thereof 北京大学 2021-03-09 — — CN claimed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 — — CN claimed
EP-1545515-A1 3-PYRROLYL-PYRIDOPYRAZOLES AND 3-PYRROLYL-INDAZOLES AS NOVEL KINASE INHIBITORS Sugen, Inc. (US) 2005-06-29 — — EP claimed
EP-1372686-B1 METHODS AND COMPOSITIONS FOR PEPTIDE SYNTHESIS TRIMERIS INC (US) 2005-02-02 — — EP claimed
WO-2004099127-A1 NOVEL COMPOUNDS AS KINASE INHIBITORS NOVO NORDISK A/S (DK) 2004-11-18 — — WO claimed
US-20040092546-A1 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors SUGEN, INC. 2004-05-13 — — US claimed
WO-2004014368-A1 3-PYRROLYL-PYRIDOPYRAZOLES AND 3-PYRROLYL-INDAZOLES AS NOVEL KINASE INHIBITORS SUGEN, INC. (US) 2004-02-19 — — WO claimed
JP-2868313-B2 — — 1999-03-10 — — JP claimed
EP-0454511-B1 N-substituted heterocycle derivatives, their preparation, compositions containing them SANOFI SA (FR) 1998-06-17 — — EP claimed
EP-0532410-A1 N-substituted heterocyclic derivatives as angiotensin II inhibitors SANOFI (FR) 1993-03-17 — — EP claimed
EP-0454511-A1 N-substituted heterocycle derivatives, their preparation, compositions containing them SANOFI (FR) 1991-10-30 — — EP claimed
WO-1991014679-A1 HETEROCYCLIC N-SUBSTITUTED DERIVATIVES, THEIR PREPARATION AND THEPHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI (FR) 1991-10-03 — — WO claimed

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

For each of this compound's patents that has machine-readable text (1 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-20040092546-A1 3-Pyrrol-pyridopyrazoles and 3-pyrrolyl-indazoles as novel kinase inhibitors MAP3K19, MAP3K1, MAP3K7 TAAR1 3622/4885HRH3 2602/4885LOXL2 2185/4885

“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.

Send feedback