SCHEMBL697507

SCHEMBL697507

NNCc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.56
CYP3A4 P08684 1/20 0.54
MAPT P10636 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
CHRM2 P08172 1/20 0.50
TAAR1 Q96RJ0 1/20 0.48
AGXT P21549 2/20 0.46
SLC6A4 P31645 1/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA9 Q16790 1/20 0.46
ALOX12 P18054 1/20 0.46
POLB P06746 1/20 0.45

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
Hydrochloric Acid SCHEMBL15015612 0.97 CYP3A4 (0.58) IDO1CYP3A4MAPTCYP2C9CYP2C19
Hydrochloric Acid SCHEMBL8401396 0.97 CYP3A4 (0.58) IDO1CYP3A4MAPTCYP2C9CYP2C19
Acetic Acid SCHEMBL3847551 0.85 CYP2C9 (0.56) IDO1CYP3A4MAPTCYP2C9CYP2C19
SCHEMBL415949 0.78 CHRM2 (0.67) IDO1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL25588042 0.76 IDO1 (0.55) IDO1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL16938676 0.76 IDO1 (0.59) IDO1CYP3A4MAPTCYP2C9CYP2C19
Hydrochloric Acid SCHEMBL7695180 0.76 CHRM2 (0.64) IDO1CYP2C9CYP2C19MEN1KMT2A
Hydrochloric Acid SCHEMBL7345756 0.76 MEN1 (0.54) IDO1CYP2C9CYP2C19MEN1KMT2A
SCHEMBL12712054 0.76 IDO1 (0.59) IDO1CYP3A4MAPTMEN1KMT2A
SCHEMBL11953353 0.75 CHRM2 (0.57) IDO1CYP2C9CYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025011546-A1 HUMAN CASEINOLYTIC PROTEASE P AGONISTS AND USES THEREOF ACELON THERAPEUTICS (CN) 2025-01-16 WO disclosed
CN-114956933-A Marker containing isotope oxygen atom and preparation method and application thereof 清华大学 2022-08-30 CN disclosed
EP-3719017-A2 COMPOUND FUNCTIONING AS BROMODOMAIN PROTEIN INHIBITOR, AND COMPOSITION Betta Pharmaceuticals Co., Ltd. (CN) 2020-10-07 EP disclosed
WO-2016182968-A1 NOVEL SYRINGOLIN ANALOGUES AND METHODS OF MAKING AND USING SAME BROWN UNIVERSITY (US) 2016-11-17 WO disclosed
EP-2342203-B1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2015-11-04 EP disclosed
US-9006238-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2015-04-14 US disclosed
WO-2014167528-A1 SPIROPYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF FOR THE TREATMENT OF VIRAL INFECTIONS NOVARTIS AG (CH) 2014-10-16 WO disclosed
WO-2014167528-A1 SPIROPYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF FOR THE TREATMENT OF VIRAL INFECTIONS NOVARTIS AG (CH) 2014-10-16 WO disclosed
CN-102137862-B Pyrazolopyridine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA 2014-07-02 CN disclosed
EP-2421826-B1 PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS HOFFMANN LA ROCHE (CH) 2013-10-23 EP disclosed
US-4061653-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE BAYER AKTIENGESELLSCHAFT (DT) 1977-12-06 US disclosed
US-4056533-A HYPOTENSIVE AGENTS, ANTICOAGULANTS, DIURETICS BAYER AKTIENGESELLSCHAFT (DT) 1977-11-01 US disclosed
US-4032646-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1977-06-28 US disclosed
US-4000294-A DIURESIS OR SALURESIS BAYER AKTIENGESELLSCHAFT (DT) 1976-12-28 US disclosed
US-3992446-A ANTIPROTOZOAL ACTIVITY, PARTICULARLY AGAINST COCCIDIOSIS AND MALARIA AMERICAN CYANAMID COMPANY (US) 1976-11-16 US disclosed
US-3992404-A DIURETICS, SALURETICS, ANTIHYPERTENSIVE AGENTS, AND ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DT) 1976-11-16 US disclosed
US-3952008-A DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US disclosed
US-3950528-A HYPOTENSIVE AGENTS, SALURETICS, DIURETICS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed
US-3949083-A DIURETICS, SALURETICS, HYPERTENSION BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 US disclosed
US-3941825-A ANTIPROTOZOA INTERMEDIATES AMERICAN CYANAMID COMPANY (US) 1976-03-02 US disclosed