SCHEMBL7203532

SCHEMBL7203532

O=C(C#Cc1cccs1)c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FFAR1 O14842 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
VCP P55072 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GSK3B P49841 2/20 0.38
ADCY1 Q08828 1/20 0.36
GRM5 P41594 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
LMNA P02545 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36

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
SCHEMBL7200606 0.85 APP (0.49) MAPTABL1MEN1KMT2AFFAR1
SCHEMBL7202747 0.85 HSP90AA1 (0.49) MAPTMEN1KMT2AFFAR1CES1
SCHEMBL7204230 0.84 APP (0.47) MAPTMEN1KMT2AFFAR1CES2
SCHEMBL7201310 0.84 VCP (0.57) MAPTMEN1KMT2AFFAR1CES2
SCHEMBL7203523 0.84 RAB9A (0.49) MAPTMEN1KMT2AFFAR1CES2
SCHEMBL7204585 0.84 APP (0.51) MAPTMEN1KMT2AFFAR1CES2
SCHEMBL7205479 0.83 VCP (0.44) MAPTMEN1KMT2AFFAR1VCP
SCHEMBL7200317 0.81 CES2 (0.44) FFAR1CES2CES1GSK3BGRM5
SCHEMBL7202454 0.80 MAPT (0.46) MAPTMEN1KMT2AVCPSMN1; SMN2
SCHEMBL7200084 0.80 RAB9A (0.50) MAPTMEN1KMT2AFFAR1VCP

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 MAPT 4683/4885ABL1 3542/4885BCR 2635/4885

“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.