SCHEMBL91535

SCHEMBL91535

CCc1csc(NC(=O)NCCc2ccc(F)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
ROCK2 O75116 2/20 0.50
ROCK1 Q13464 2/20 0.50
LMNA P02545 2/20 0.49
FPR2 P25090 1/20 0.49
CNR1 P21554 1/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
HPGD P15428 1/20 0.47
AOC3 Q16853 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.45
KDM4E B2RXH2 1/20 0.45
KMT2A Q03164 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
SCHEMBL91393 0.88 ROCK2 (0.64) MAPTROCK2ROCK1LMNACNR1
SCHEMBL91611 0.86 FPR2 (0.55) MAPTROCK2ROCK1LMNAFPR2
SCHEMBL91380 0.83 TRPV1 (0.48) MAPTROCK2ROCK1LMNACNR1
SCHEMBL77444 0.82 KMT2A (0.55) MAPTROCK2ROCK1LMNAFPR2
SCHEMBL91525 0.81 LMNA (0.70) MAPTROCK2ROCK1LMNARAB9A
SCHEMBL91577 0.80 CNR1 (0.56) MAPTROCK2ROCK1LMNACNR1
SCHEMBL10083282 0.77 LMNA (0.58) LMNARAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL10082147 0.77 CNR1 (0.50) MAPTFPR2CNR1RAB9ANPC1
SCHEMBL10237515 0.77 ROCK1 (0.67) ROCK2ROCK1
SCHEMBL10084855 0.76 LMNA (0.57) LMNARAB9ANPC1SMN1; SMN2ALDH1A1

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-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 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-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 MAPT 2769/4885ROCK2 2794/4885ROCK1 2709/4885

“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.