SCHEMBL7206441

SCHEMBL7206441

Cc1ccc(-c2ccc(C3CC(c4cccs4)=NN3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
YAP1 P46937 1/20 0.43
TEAD4 Q15561 1/20 0.43
KDM4E B2RXH2 4/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.42
NFKB1 P19838 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 1/20 0.42
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 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
SCHEMBL7204245 0.89 MAOA (0.43) MEN1KMT2ARAB9AKDM4EMAPT
SCHEMBL7200597 0.87 CA1 (0.52) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL7204253 0.82 CA1 (0.40) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL7205959 0.82 MEN1 (0.48) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL7202014 0.82 CA1 (0.56) MEN1KMT2ARAB9AKDM4EMAPT
SCHEMBL7200587 0.82 PRKCZ (0.48) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL7200609 0.82 MEN1 (0.48) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL7201265 0.82 MEN1 (0.39) MEN1KMT2ARAB9ANPC1YAP1
SCHEMBL7200534 0.82 SMN1; SMN2 (0.46) PSMD14MEN1KMT2ARAB9AKDM4E
SCHEMBL7204267 0.82 MEN1 (0.38) PSMD14MEN1KMT2ARAB9ANPC1

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 PSMD14 3816/4885MEN1 4820/4885KMT2A 3922/4885

“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.