SCHEMBL7203229

SCHEMBL7203229

O=C(C#Cc1cccs1)c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 6/20 0.44
KMT2A Q03164 6/20 0.44
KDM4E B2RXH2 4/20 0.44
MAPK1 P28482 2/20 0.44
PKM P14618 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAPT P10636 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 2/20 0.40
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
MEN1 O00255 5/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 3/20 0.38
LMNA P02545 1/20 0.38
FFAR1 O14842 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL7202358 0.84 ALDH1A1 (0.44) TP53L3MBTL1ALDH1A1KMT2AMAPT
SCHEMBL7202005 0.84 SMN1; SMN2 (0.50) ALDH1A1KMT2AKDM4EMAPK1MAPT
SCHEMBL29693871 0.81 CTNNB1 (0.50) ALDH1A1KMT2AKDM4ECES2CES1
SCHEMBL7199134 0.81 CTNNB1 (0.50) ALDH1A1KMT2AKDM4ECES2CES1
SCHEMBL28672048 0.78 MAPK1 (0.43) L3MBTL1ALDH1A1KMT2AMAPK1PKM
SCHEMBL7205541 0.78 CTNNB1 (0.56) TP53ALDH1A1KMT2AMAPTPOLB
SCHEMBL7202747 0.77 HSP90AA1 (0.49) TP53ALDH1A1KMT2AKDM4EMAPK1
SCHEMBL29625158 0.77 NPC1 (0.51) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL28745771 0.77 NPC1 (0.51) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL7203523 0.76 RAB9A (0.49) TP53L3MBTL1ALDH1A1KMT2AMAPK1

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 TP53 4681/4885L3MBTL1 324/4885ALDH1A1 1476/4885

“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.