SCHEMBL6740040

SCHEMBL6740040

O=C(O)c1snc(-c2ccc(Cl)cc2Cl)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.44
SRD5A2 P31213 1/20 0.43
CDC7 O00311 2/20 0.42
CCNE1 P24864 2/20 0.42
CDK2 P24941 2/20 0.42
DBF4 Q9UBU7 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
BCKDK O14874 1/20 0.42
MCL1 Q07820 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
CRHBP P24387 1/20 0.41
RAB9A P51151 1/20 0.41
CRHR2 Q13324 1/20 0.41
MARS1 P56192 1/20 0.41

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
SCHEMBL14953190 0.85 CDC7 (0.43) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL6735476 0.83 ALPL (0.49) ALPLCDC7DBF4SMN1; SMN2ALDH1A1
SCHEMBL6985020 0.78 CNR1 (0.40) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL10999095 0.78 NPC1 (0.46) ALPLSMN1; SMN2ALDH1A1TSHRBCKDK
SCHEMBL11003546 0.76 KMO (0.44) SMN1; SMN2NPC1RAB9AKMT2ACSNK2A2
SCHEMBL4373610 0.76 RORB (0.46) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL952934 0.75 CDC7 (0.50) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL13257644 0.74 CDC7 (0.49) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL4369005 0.73 SMN1; SMN2 (0.50) ALPLSRD5A2CDC7CCNE1CDK2
SCHEMBL6741266 0.72 ALPL (0.47) ALPLCDC7CCNE1CDK2DBF4

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-20040023807-A1 3-Arylisothiazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-02-05 US disclosed
EP-1289970-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-03-12 EP disclosed
WO-2001087863-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-11-22 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-20040023807-A1 3-Arylisothiazoles and their use as herbicides DDT, HAX1, SULT1E1 ALPL 3150/4885SRD5A2 1792/4885CDC7 4159/4885

“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.