SCHEMBL4173835

SCHEMBL4173835

Cc1nn(C)cc1C(=O)NC(Cc1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 1/20 0.53
CTSL P07711 1/20 0.53
CTSS P25774 1/20 0.53
CTSK P43235 1/20 0.53
TACR3 P29371 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
RAB9A P51151 1/20 0.49
ATM Q13315 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
MAPK1 P28482 2/20 0.47
DCAF1 Q9Y4B6 1/20 0.46
NAMPT P43490 1/20 0.45
CCR3 P51677 1/20 0.44

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
SCHEMBL4174184 0.84 TACR3 (0.48) TACR3SMN1; SMN2ALDH1A1HTTNCOA1
SCHEMBL4173862 0.83 MAPK1 (0.51) CTSLTACR3SMN1; SMN2GAAALDH1A1
SCHEMBL28510286 0.82 ALDH1A1 (0.55) SMN1; SMN2CYP1A2GAACYP2C9CYP2C19
SCHEMBL28509439 0.82 ALDH1A1 (0.55) SMN1; SMN2CYP1A2GAACYP2C9CYP2C19
SCHEMBL28509438 0.82 ALDH1A1 (0.55) SMN1; SMN2CYP1A2GAACYP2C9CYP2C19
SCHEMBL22885966 0.80 CTSV (0.48) CTSVCTSLCTSSCTSKSMN1; SMN2
SCHEMBL9330037 0.79 GAA (0.50) CTSVCTSLCTSSCTSKSMN1; SMN2
SCHEMBL10705514 0.78 CTSS (0.50) CTSVCTSLCTSSCTSKSMN1; SMN2
SCHEMBL7256231 0.74 TACR3 (0.53) TACR3SMN1; SMN2ALDH1A1HTTNCOA1
SCHEMBL9330039 0.74 ATM (0.53) CTSVCTSLCTSSCTSKSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123561-A1 Fungicide mixtures based on 1-methyl-pyrazol-4-ylcarboxanilides BASF AKTIENGESELLLSCHAFT (DE) 2009-05-14 US claimed
US-20090123561-A1 Fungicide mixtures based on 1-methyl-pyrazol-4-ylcarboxanilides BASF AKTIENGESELLLSCHAFT (DE) 2009-05-14 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-20090123561-A1 Fungicide mixtures based on 1-methyl-pyrazol-4-ylcarboxanilides CBR3, CBR1, CTRL CTSV 3244/4885CTSL 2055/4885CTSS 1640/4885

“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.