SCHEMBL91611

SCHEMBL91611

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

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.55
ROCK2 O75116 3/20 0.53
ROCK1 Q13464 3/20 0.53
CNR1 P21554 1/20 0.53
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TRPV1 Q8NER1 1/20 0.49
GLA P06280 1/20 0.49
KMT2A Q03164 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
RAB9A P51151 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL91535 0.86 MAPT (0.51) FPR2ROCK2ROCK1CNR1LMNA
SCHEMBL91393 0.86 ROCK2 (0.64) ROCK2ROCK1CNR1LMNASMN1; SMN2
SCHEMBL77071 0.83 KMT2A (0.69) FPR2ROCK2ROCK1CNR1SMN1; SMN2
SCHEMBL2559922 0.81 ROCK1 (0.80) ROCK2ROCK1KMT2AMAPTMAPK1
SCHEMBL91380 0.81 TRPV1 (0.48) ROCK2ROCK1CNR1LMNASMN1; SMN2
SCHEMBL10081817 0.79 TP53 (0.54) LMNASMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL91525 0.79 LMNA (0.70) ROCK2ROCK1LMNASMN1; SMN2KMT2A
SCHEMBL10082863 0.78 FPR2 (0.59) FPR2ROCK2ROCK1CNR1LMNA
SCHEMBL91577 0.78 CNR1 (0.56) ROCK2ROCK1CNR1LMNASMN1; SMN2
SCHEMBL91529 0.78 ROCK1 (0.70) ROCK2ROCK1LMNAKMT2ARAB9A

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 FPR2 3656/4885ROCK2 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.