SCHEMBL7327889

SCHEMBL7327889

O=C(O)c1c(Cl)[nH]c2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.65
KDM4E B2RXH2 4/20 0.62
TDP1 Q9NUW8 1/20 0.62
APP P05067 1/20 0.49
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
RAB9A P51151 2/20 0.47
MITF O75030 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 4/20 0.47
HPGD P15428 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
AHR P35869 1/20 0.47

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 SCHEMBL11578765 0.98 NR4A2 (0.63) NR4A2KDM4ETDP1APPKMT2A
SCHEMBL11578762 0.85 NR4A2 (0.65) NR4A2KDM4ETDP1KMT2AALDH1A1
SCHEMBL8504135 0.83 NR4A2 (0.68) NR4A2KDM4ETDP1KMT2AALDH1A1
SCHEMBL25334740 0.82 NR4A2 (0.58) NR4A2KDM4ETDP1KMT2AALDH1A1
SCHEMBL27390539 0.80 NR4A2 (0.59) NR4A2KDM4ETDP1KMT2AALDH1A1
SCHEMBL5137730 0.79 NR4A2 (1.00) NR4A2KDM4EKMT2AALDH1A1LMNA
SCHEMBL27677910 0.78 KDM4E (0.65) NR4A2KDM4ETDP1APPKMT2A
SCHEMBL17559719 0.78 MEN1 (0.65) KDM4ETDP1KMT2AALDH1A1MEN1
SCHEMBL87871 0.78 KDM4E (0.65) KDM4ETDP1APPKMT2AALDH1A1
SCHEMBL28165761 0.78 APP (0.54) NR4A2KDM4ETDP1APPDPP4

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11641858-B2 Agricultural chemicals REDAG CROP PROTECTION LTD. (GB) 2023-05-09 US disclosed
CN-109879790-A Using indoles or indoles analog as the amides small molecular organic compounds of mother nucleus structure, purposes and preparation method thereof 华东师范大学 2019-06-14 CN disclosed
US-5998409-A GASTROINTESTINAL DISORDERS; CARDIOVASCULAR DISORDERS; NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM PLC (GB) 1999-12-07 US disclosed
EP-0630376-B1 CONDENSED INDOLE DERIVATIVES AS 5-HT4-RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-06-02 EP disclosed
US-5852014-A Condensed indole derivatives as 5HT4 -receptor antagonists SMITHKLINE BEECHAM P.L.C. (GB) 1998-12-22 US disclosed
US-5556874-A ENZYME INHIBITORS AS ANTICARCINOGENIC AGENTS WARNER LAMBERT COMPANY (US) 1996-09-17 US disclosed
US-5464861-A Anticarcinogenic agents WARNER-LAMBERT (US) 1995-11-07 US disclosed
EP-0654024-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1995-05-24 EP disclosed
EP-0630376-A1 CONDENSED INDOLE DERIVATIVES AS 5HT 4?-RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-12-28 EP disclosed
WO-1994003427-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1994-02-17 WO disclosed
WO-1993018036-A1 CONDENSED INDOLE DERIVATIVES AS 5HT4-RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-09-16 WO disclosed
US-4789673-A ANTISEROTONINE AGENTS NOVARTIS AG (CH) 1988-12-06 US disclosed
US-4148895-A HYPOTENSIVE, ANTIARRHYMIA AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1979-04-10 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 (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-11641858-B2 Agricultural chemicals DDT, CYP4X1, CYP1A2 NR4A2 2369/4885KDM4E 627/4885TDP1 1947/4885

“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.