SCHEMBL7202530

SCHEMBL7202530

Clc1ccc(-c2cc(-c3cccs3)[nH]n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.56
KMT2A Q03164 9/20 0.54
MEN1 O00255 8/20 0.54
RAB9A P51151 5/20 0.54
NPC1 O15118 3/20 0.54
MAPT P10636 5/20 0.52
NFKB1 P19838 1/20 0.52
AHR P35869 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
HPGD P15428 3/20 0.49
ALOX15 P16050 2/20 0.49
MCL1 Q07820 2/20 0.49
LMNA P02545 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
POLB P06746 2/20 0.49
PKM P14618 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 2/20 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
SCHEMBL7203773 0.88 MKNK1 (0.53) ADORA3KMT2AMEN1RAB9ANPC1
SCHEMBL7200957 0.85 ADORA3 (0.56) ADORA3KMT2AMEN1RAB9ANPC1
SCHEMBL17279986 0.83 ADORA3 (0.60) ADORA3KMT2AMEN1RAB9AMAPT
SCHEMBL7203746 0.81 KMT2A (0.56) ADORA3KMT2AMEN1RAB9ANPC1
SCHEMBL13312316 0.77 APP (0.78) KMT2AMEN1RAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL3497967 0.76 APP (0.76) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL17570209 0.76 POLB (0.62) ADORA3KMT2AMEN1RAB9AMAPT
SCHEMBL4942074 0.76 KMT2A (0.50) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL6231163 0.76 RAB9A (0.79) ADORA3KMT2AMEN1RAB9ANPC1
SCHEMBL9049719 0.74 GCGR (0.62) KMT2AMEN1RAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ADORA3 842/4885KMT2A 3922/4885MEN1 4820/4885

“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.