SCHEMBL7205969

SCHEMBL7205969

Cc1ccc(C(=O)C#Cc2cccs2)c(S)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.38
POLB P06746 1/20 0.36
RAB9A P51151 8/20 0.35
NPC1 O15118 7/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
GAA P10253 4/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 3/20 0.34
MAPT P10636 2/20 0.34
ALOX15 P16050 1/20 0.34
GFER P55789 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FFAR1 O14842 1/20 0.34
VCP P55072 1/20 0.33
TSHR P16473 1/20 0.33
ERN1 O75460 1/20 0.33
LMNA P02545 1/20 0.33
ALOX12 P18054 1/20 0.33

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
SCHEMBL7207749 0.83 GRM5 (0.35) GRM5POLBRAB9ANPC1SMN1; SMN2
SCHEMBL7201310 0.77 VCP (0.57) GRM5RAB9ANPC1SMN1; SMN2GAA
SCHEMBL7203118 0.76 KCNK3 (0.45) GRM5RAB9ANPC1SMN1; SMN2GAA
SCHEMBL7204957 0.73 VCP (0.53) GRM5RAB9ANPC1SMN1; SMN2GAA
SCHEMBL7202005 0.72 SMN1; SMN2 (0.50) RAB9ANPC1SMN1; SMN2GAAMEN1
SCHEMBL7204989 0.72 CES2 (0.45) POLBRAB9ANPC1SMN1; SMN2GAA
SCHEMBL7202023 0.71 ALDH1A1 (0.51) POLBRAB9ANPC1SMN1; SMN2GAA
SCHEMBL7845479 0.71 VCP (0.50) GRM5RAB9ANPC1SMN1; SMN2GAA
SCHEMBL7205459 0.70 GRM5 (0.38) GRM5KMT2AALDH1A1MAPTERN1
SCHEMBL7199134 0.70 CTNNB1 (0.50) RAB9ANPC1GAAMEN1KMT2A

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 3 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

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 GRM5 1963/4885POLB 4420/4885RAB9A 1643/4885

“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.