SCHEMBL218119

SCHEMBL218119

c1ccc(-c2c[nH]nc2-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.52
ALDH1A1 P00352 5/20 0.45
MAPT P10636 3/20 0.45
GFER P55789 1/20 0.45
KDM4E B2RXH2 4/20 0.43
GAA P10253 3/20 0.43
HPGD P15428 3/20 0.43
ALPL P05186 1/20 0.43
IDO1 P14902 1/20 0.43
TTK P33981 1/20 0.43
MAPK10 P53779 1/20 0.43
AKT1 P31749 2/20 0.41
AKT2 P31751 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DCUN1D2 Q6PH85 1/20 0.40

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
SCHEMBL28197453 0.91 ALOX15 (0.43) ALOX15ALDH1A1MAPTGFERKDM4E
Pyridine SCHEMBL27988808 0.90 ALOX15 (0.43) ALOX15ALDH1A1MAPTGFERKDM4E
SCHEMBL5256518 0.90 NOTUM (0.52) ALOX15MAPK10AKT1SMN1; SMN2NPC1
SCHEMBL3108967 0.88 TDP1 (0.52) ALOX15ALDH1A1MAPTKDM4EHPGD
SCHEMBL1128951 0.88 ALDH1A1 (0.50) ALOX15ALDH1A1MAPTKDM4EHPGD
SCHEMBL1129154 0.88 ALDH1A1 (0.50) ALOX15ALDH1A1MAPTKDM4EHPGD
SCHEMBL28329372 0.88 ADORA1 (0.49) ALOX15ALDH1A1MAPK10SMN1; SMN2
SCHEMBL9246456 0.86 ALDH1A1 (0.47) ALOX15ALDH1A1MAPTGFERKDM4E
SCHEMBL4282428 0.84 MAOB (0.46) IDO1NPC1RAB9AERBB2GRM5
SCHEMBL5451902 0.82 IMPDH2 (0.44) MAPTMAPK10AKT1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12617771-B2 Diphenylpyrazole compound, and preparation method therefor and application thereof NORTHWEST A&F UNIVERSITY (CN) 2026-05-05 US claimed
CN-119055639-A Application of diphenylpyrazole compound in preparation of medicine for treating tuberculosis 西北农林科技大学 2024-12-03 CN claimed
CN-118678881-A Application of diphenylpyrazole compound as herbicide synergist 西北农林科技大学 2024-09-20 CN claimed
CN-118591293-A Weeding composition 西北农林科技大学 2024-09-03 CN claimed
US-20240083871-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF NORTHWEST A&F UNIVERSITY (CN) 2024-03-14 US claimed
CN-117658918-A Application of diphenylpyrazole compound 西北农林科技大学 2024-03-08 CN claimed
CN-114716409-B Diphenyl pyrazole compound and preparation method and application thereof 西北农林科技大学 2024-01-12 CN claimed
WO-2023202544-A1 HERBICIDAL COMPOSITION 西北农林科技大学 2023-10-26 WO claimed
WO-2023202545-A1 USE OF DIPHENYL PYRAZOLE COMPOUND AS HERBICIDE SYNERGIST 西北农林科技大学 2023-10-26 WO claimed
CN-114716409-A Diphenyl pyrazole compound and preparation method and application thereof 西北农林科技大学 2022-07-08 CN claimed
CN-114075138-A Stable isotope labeled difenzoquat and synthetic method thereof 上海安谱实验科技股份有限公司 2022-02-22 CN claimed
CN-107935928-B Total diphenylpyrazole and preparation method and application thereof 鲁东大学 2021-05-25 CN claimed
CN-109851560-B Biphenyl diazole derivative and preparation method and application thereof 河南新天地药业股份有限公司 2020-07-07 CN claimed
CN-107935928-A A kind of total diphenylpypazole and its preparation method and application 鲁东大学 2018-04-20 CN claimed
US-20160271143-A1 ESTROGEN RECEPTOR MODULATORS FOR REDUCING BODY WEIGHT ROSSCREENING INC (US) 2016-09-22 US claimed
US-20140378424-A1 ESTROGEN RECEPTOR MODULATORS FOR REDUCING BODY WEIGHT ROSSCREENING INC (US) 2014-12-25 US claimed
WO-2013102207-A1 ESTROGEN RECEPTOR MODULATORS FOR REDUCING BODY WEIGHT ROSSCREENING, INC. (US) 2013-07-04 WO claimed
CN-101020662-A Compound 3,4-diaryl pyrazole and its prepn and medicinal use UNIV SHAANXI NORMAL (CN) 2007-08-22 CN claimed
US-5840913-A CATALYTIC N-ALKYLATION OF A PYRAZOLE BY REACTING WITH AN ALCOHOL; LIQUID PHASE; NON-HETEROGENOUS ACID CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 1998-11-24 US claimed
US-5468871-A Catalytic N-alkylation BASF AKTIENGESELLSCHAFT (DE) 1995-11-21 US claimed

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-12617771-B2 Diphenylpyrazole compound, and preparation method therefor and application thereof GSTP1, GSTO1, GSTA1 ALOX15 1335/4885ALDH1A1 334/4885MAPT 4639/4885
US-20240083871-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF GSTP1, CYP4F11, GSTA1 ALOX15 1460/4885ALDH1A1 467/4885MAPT 3358/4885

“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.