SCHEMBL7017242

SCHEMBL7017242

Cc1ccc(C(=O)Cl)c(Br)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 8/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
GAA P10253 2/20 0.41
CSNK2A1 P68400 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MYC P01106 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 2/20 0.38
POLB P06746 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
SCHEMBL31315013 1.00 RAB9A (0.41) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL3735051 0.83 CSNK2A1 (0.44) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL27774516 0.83 MAPT (0.44) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL12121788 0.81 NPC1 (0.41) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL1329346 0.81 CYP2A6 (0.42) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL211284 0.81 CSNK2A1 (0.55) RAB9ASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL29775265 0.81 CSNK2A1 (0.55) RAB9ASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL302204 0.80 CSNK2A1 (0.48) RAB9ASMN1; SMN2MAPTKMT2AMEN1
Benzoyl Chloride SCHEMBL28327933 0.79 POLB (0.46) RAB9ASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL305165 0.79 ERN1 (0.46) RAB9ASMN1; SMN2MAPTALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230345812-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-26 US disclosed
CN-112321648-B P-containing organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2022-12-02 CN disclosed
CN-112175016-B Organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2022-11-11 CN disclosed
CN-112321647-B Iridium complex containing benzimidazole structure and application thereof 北京燕化集联光电技术有限公司 2022-08-16 CN disclosed
CN-112341499-B Sulfur-containing organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2022-07-12 CN disclosed
CN-112209973-B Oxygen-containing organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2022-06-24 CN disclosed
CN-112175017-B Organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2022-06-14 CN disclosed
CN-112341499-A Sulfur-containing organic electrophosphorescent luminescent material and application thereof 北京燕化集联光电技术有限公司 2021-02-09 CN disclosed
CN-112321648-A P-containing organic electrophosphorescent material and application thereof 北京燕化集联光电技术有限公司 2021-02-05 CN disclosed
CN-112321647-A Iridium complex containing benzimidazole structure and application thereof 北京燕化集联光电技术有限公司 2021-02-05 CN disclosed
US-20150318498-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
US-20150318498-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
CN-104080783-A Pyrrole compounds YAKULT HONSHA KK 2014-10-01 CN disclosed
WO-2014094962-A2 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-06-26 WO disclosed
EP-1289993-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2003-03-12 EP disclosed
WO-2001094351-A1 CASPASE INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2001-12-13 WO disclosed
US-5237099-A Insecticidal substituted and unsubstituted benzoic acid 1-alkyl, 2-alkyl and 2-cycloalkylhydrazides AMERICAN CYANAMID COMPANY (US) 1993-08-17 US disclosed
US-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed
US-4814349-A Insecticidal substituted and unsubstituted benzoic acid 1-alkyl, 2 alkyl and 2-cycloalkylhydrazides AMERICAN CYANAMID COMPANY (US) 1989-03-21 US disclosed
EP-0228564-A2 Novel insecticidal diacylhydrazine compounds AMERICAN CYANAMID COMPANY (US) 1987-07-15 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 (2 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-20230345812-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OPRD1, OCIAD2 RAB9A 799/4885SMN1; SMN2 3117/4885MAPT 4205/4885
US-20150318498-A1 Metal Complexes SOD1, AP1M1, AP3M1 RAB9A 2201/4885SMN1; SMN2 3736/4885MAPT 1084/4885

“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.