SCHEMBL8765128

SCHEMBL8765128

Cc1nn(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 11/20 0.67
NPC1 O15118 10/20 0.67
RAB9A P51151 10/20 0.67
CYP1A2 P05177 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
HIF1A Q16665 1/20 0.57
HPGD P15428 2/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 7/20 0.50
ALDH1A1 P00352 5/20 0.50
NPSR1 Q6W5P4 3/20 0.50
TP53 P04637 3/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 3/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
NFKB1 P19838 3/20 0.48
NFKB2 Q00653 3/20 0.48
RELA Q04206 3/20 0.48

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
SCHEMBL31500066 0.93 SMN1; SMN2 (0.59) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL31500050 0.91 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL31500065 0.91 NPC1 (0.56) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL31500051 0.88 NPC1 (0.71) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL28299664 0.85 CYP1A2 (0.54) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL31500056 0.85 RAB9A (0.54) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL28299531 0.83 CYP1A2 (0.52) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL28299741 0.83 RAB9A (0.54) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL11128071 0.83 CYP2C19 (0.63) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9
SCHEMBL31500060 0.83 SMN1; SMN2 (0.69) SMN1; SMN2NPC1RAB9ACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119900034-A Synthesis method of polysubstituted pyrazole compound 广西师范大学 2025-04-29 CN disclosed
US-11659766-B2 Organic semiconductor material for electron transport DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2023-05-23 US disclosed
US-11659766-B2 Organic semiconductor material for electron transport DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2023-05-23 US disclosed
US-11345688-B2 Compound, preparing method therefor, and organic light emitting element comprising same DAEGU GYEONGBUK INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2022-05-31 US disclosed
US-20190189933-A1 ORGANIC SEMICONDUCTOR MATERIAL FOR ELECTRON TRANSPORT DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2019-06-20 US disclosed
EP-0731794-B1 1,4,5-TRIPHENYL PYRAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION AND INFLAMMATION-RELATED DISORDERS SEARLE & CO (US) 1997-08-06 EP disclosed
US-5639777-A 1,4,5-triphenyl pyrazolyl compounds for the treatment of inflammation and inflammation-related disorders G.D. SEARLE & CO. (US) 1997-06-17 US disclosed
US-5401765-A FOR TREATING ARTHRITIS, PAIN AND FEVER Searle, G. D. (US) 1995-03-28 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-11345688-B2 Compound, preparing method therefor, and organic light emitting element comprising same CYP4F11, CYP4A11, WEE2 SMN1; SMN2 4230/4885NPC1 1405/4885RAB9A 4203/4885

“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.