SCHEMBL7207209

SCHEMBL7207209

O=C(C#Cc1cccs1)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.43
BCL2L1 Q07817 1/20 0.42
BAD Q92934 1/20 0.42
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
POLB P06746 1/20 0.38
PTGS1 P23219 3/20 0.38
PTPN1 P18031 1/20 0.37
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TNFRSF1A P19438 1/20 0.36
NPC1 O15118 1/20 0.36
FFAR1 O14842 1/20 0.36
PTGER2 P43116 1/20 0.36
VCP P55072 1/20 0.36
ABL1 P00519 1/20 0.35
BCR P11274 1/20 0.35
CES2 O00748 1/20 0.35

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
SCHEMBL7204230 0.95 APP (0.47) APPMEN1KMT2APOLBPTPN1
SCHEMBL7832775 0.89 RAB9A (0.43) APPMEN1KMT2ARAB9AALDH1A1
SCHEMBL7205479 0.88 VCP (0.44) MEN1KMT2APTPN1RAB9AALDH1A1
SCHEMBL7204957 0.85 VCP (0.53) MEN1KMT2ARAB9AALDH1A1KDM4E
SCHEMBL7200606 0.81 APP (0.49) APPMEN1KMT2APOLBRAB9A
SCHEMBL7202747 0.81 HSP90AA1 (0.49) MEN1KMT2ARAB9AALDH1A1KDM4E
SCHEMBL7200317 0.81 CES2 (0.44) PTPN1RAB9AFFAR1CES2CES1
SCHEMBL7201310 0.80 VCP (0.57) MEN1KMT2ARAB9AALDH1A1NPC1
SCHEMBL7204585 0.80 APP (0.51) APPMEN1KMT2APOLBRAB9A
SCHEMBL7203523 0.80 RAB9A (0.49) MEN1KMT2ARAB9AALDH1A1NPSR1

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 APP 4809/4885BCL2L1 1259/4885BAD 2039/4885

“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.