SCHEMBL7203773

SCHEMBL7203773

Clc1ccc(-c2cc(-c3cccs3)n[nH]2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.53
MKNK2 Q9HBH9 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 4/20 0.49
NPC1 O15118 2/20 0.49
POLB P06746 2/20 0.49
ADORA3 P0DMS8 1/20 0.49
PKM P14618 1/20 0.49
MCL1 Q07820 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.46
APP P05067 1/20 0.46
NFKB1 P19838 1/20 0.46
AHR P35869 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
LTA4H P09960 1/20 0.46

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
SCHEMBL7202530 0.88 ADORA3 (0.56) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL6417475 0.86 RAB9A (0.62) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL6413241 0.81 MAPT (0.66) SMN1; SMN2MEN1KMT2ARAB9AMAPT
SCHEMBL9048321 0.78 MKNK1 (0.56) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL13312316 0.77 APP (0.78) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL9045673 0.77 MKNK1 (0.50) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL3497967 0.76 APP (0.76) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL6231163 0.76 RAB9A (0.79) MKNK1MKNK2MEN1KMT2ARAB9A
SCHEMBL9049719 0.74 GCGR (0.62) MKNK1MKNK2SMN1; SMN2MEN1KMT2A
SCHEMBL17279986 0.73 ADORA3 (0.60) SMN1; SMN2MEN1KMT2ARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0731796-A1 1,3,5-TRISUBSTITUTED PYRAZOLE COMPOUNDS FOR TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-09-18 EP claimed
WO-1995015318-A1 1,3,5-TRISUBSTITUTED PYRAZOLE COMPOUNDS FOR TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1995-06-08 WO claimed
US-6605730-B2 3-(2-Thienyl)-5-phenyl-1H-pyrazole compounds of given formula NIHON BAYER AGROCHEM K.K. (JP) 2003-08-12 US disclosed
US-20030028034-A1 Nematicidal pyrazoles WADA KATSUAKI (JP) 2003-02-06 US disclosed
US-6310049-B1 3-(2-THIENYL),5-(SUBSTITUTED PHENYL)-1H-PYRAZOLES AND 3-(SUBSTITUTED PHENYL),5-(2-THIENYL)-1H-PYRAZOLES OF GIVEN FORMULA; ANTHELMINTICS NIHON BAYER AGROCHEM K.K. (JP) 2001-10-30 US disclosed
EP-1104418-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2001-06-06 EP disclosed
WO-2000009500-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-24 WO 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-20030028034-A1 Nematicidal pyrazoles CBR3, CBR1, CCR4 MKNK1 3868/4885MKNK2 3511/4885SMN1; SMN2 3988/4885

“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.