SCHEMBL1923692

SCHEMBL1923692

BrC1Cc2ccccc2C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
PLAU P00749 1/20 0.42
ANPEP P15144 2/20 0.40
TSHR P16473 1/20 0.38
DRD3 P35462 1/20 0.38
PRCP P42785 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL31490422 1.00 IDO1 (0.46) IDO1PLAUANPEPTSHRDRD3
SCHEMBL1243147 0.82 PLAU (0.56) PLAUANPEPTSHRCA1CA2
SCHEMBL6256650 0.77 CYP19A1 (0.50) TSHR
SCHEMBL27766681 0.75 IDO1 (0.46) IDO1PLAUANPEPTSHRDRD3
SCHEMBL8809848 0.73 IDO1 (0.35) IDO1DRD3
SCHEMBL6300596 0.73 CYP1A2 (0.46) IDO1PLAUANPEPCA1CA2
SCHEMBL27566376 0.71 MTNR1A (0.44) TSHR
SCHEMBL7458168 0.71 PLAU (0.45) IDO1PLAUANPEPCA1CA2
SCHEMBL7458173 0.71 PLAU (0.45) IDO1PLAUANPEPCA1CA2
SCHEMBL7458183 0.71 PLAU (0.45) IDO1PLAUANPEPCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112645971-B Method for directly preparing alkyl borate compound from alkyl halide 中国科学院兰州化学物理研究所 2021-12-24 CN claimed
JP-4347906-B2 2009-10-21 JP claimed
EP-0828848-B1 PREPARATION OF HYDROXY COMPOUNDS BY BIOCONVERSION WITH DIOXYGENASE AVECIA LTD (GB) 2002-03-27 EP claimed
US-6087137-A PREPARING OPTICALLY ACTIVE COMPOUNDS FOR USE AS CHEMICAL INTERMEDIATES IN SYNTHESIS OF DRUGS AND AGRICULTURAL CHEMICALS ESPECIALLY ENZYME INHIBITORS TARGETED TO HUMAN IMMUNODEFICIENCY VIRUS ZENECA LIMITED (GB) 2000-07-11 US claimed
EP-0828848-A1 PREPARATION OF HYDROXY COMPOUNDS BY BIOCONVERSION WITH DIOXYGENASE ZENECA LIMITED (GB) 1998-03-18 EP claimed
WO-1996037628-A1 PREPARATION OF HYDROXY COMPOUNDS BY BIOCONVERSION WITH DIOXYGENASE ZENECA LIMITED (GB) 1996-11-28 WO claimed
US-20260080976-A1 SYSTEM AND METHODS FOR GENERATION OF FRAGMENT MODULE LIBRARIES FOR LEAD OPTIMIZATION OF PHARMACEUTICALLY ACTIVE MOLECULES PURDUE RESEARCH FOUNDATION (US) 2026-03-19 US disclosed
EP-4543895-A1 NOVEL IRON-BASED COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF, AND USE THEREOF AS CATALYSTS Université Paris-Saclay (FR) 2025-04-30 EP disclosed
WO-2023247697-A1 NOVEL IRON-BASED COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF, AND USE THEREOF AS CATALYSTS Universite Paris-Saclay (FR) 2023-12-28 WO disclosed
CN-112645971-B Method for directly preparing alkyl borate compound from alkyl halide 中国科学院兰州化学物理研究所 2021-12-24 CN disclosed
WO-2021078132-A1 INHIBITORS OF MTOR-MEDIATED INDUCTION OF AUTOPHAGY SIRONAX LTD (GB) 2021-04-29 WO disclosed
CN-112645971-A Method for directly preparing alkyl borate compound from alkyl halide 中国科学院兰州化学物理研究所 2021-04-13 CN disclosed
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 EP disclosed
EP-0183492-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1989-11-15 EP disclosed
EP-0310745-A2 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÄ OY (FI) 1989-04-12 EP disclosed
WO-1988008843-A2 NEW IMIDAZOLS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1988-11-17 WO disclosed
US-4689339-A 4-dihydroinden-2-yl-, 4-tetrahydronaphth-2-yl-, and 4-dihydrobenzofuran-2-ylimidazoles, useful to block α2 -adrenergic receptors FARMOS YHTYMA OY (FI) 1987-08-25 US disclosed
US-4596791-A Containing heterocyclic fused ring USV PHARMACEUTICAL CORP. (US) 1986-06-24 US disclosed
EP-0183492-A1 Substituted imidazole derivatives and their preparation and use Farmos-Yhtyma Oy (FI) 1986-06-04 EP disclosed
EP-0121830-A2 Substituted dipeptides as antihypertensives USV PHARMACEUTICAL CORPORATION (US) 1984-10-17 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 (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-20260080976-A1 SYSTEM AND METHODS FOR GENERATION OF FRAGMENT MODULE LIBRARIES FOR LEAD OPTIMIZATION OF PHARMACEUTICALLY ACTIVE MOLECULES BACE2, ADAM33, SET IDO1 3262/4885PLAU 395/4885ANPEP 1628/4885

“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.