SCHEMBL10160107

SCHEMBL10160107

CC(C)(C)OC(=O)Nc1cccc(CNC(=O)Nc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
CCKBR P32239 1/20 0.53
NPC1 O15118 7/20 0.52
RAB9A P51151 7/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TP53 P04637 1/20 0.52
HPGD P15428 1/20 0.52
AURKA O14965 2/20 0.52
RPS6KB1 P23443 1/20 0.52
NPY1R P25929 1/20 0.52
AURKB Q96GD4 1/20 0.50
KIT P10721 1/20 0.49
DDR1 Q08345 1/20 0.49
DDR2 Q16832 1/20 0.49
KDR P35968 1/20 0.49
POLB P06746 1/20 0.49
MAOB P27338 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL165722 0.90 NAMPT (0.64) NAMPT
SCHEMBL3462483 0.90 NPC1 (0.60) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL13853708 0.89 AURKA (0.53) MAPTCCKBRNPC1RAB9ASMN1; SMN2
SCHEMBL10160407 0.88 ROCK2 (0.56) MAPTMEN1KMT2AAURKARPS6KB1
SCHEMBL10160157 0.86 SENP1 (0.55) MAPTRAB9AHPGDAURKARPS6KB1
SCHEMBL16527267 0.86 AURKA (0.54) MAPTCCKBRAURKARPS6KB1NAMPT
SCHEMBL31710947 0.86 AURKA (0.54) MAPTCCKBRAURKARPS6KB1NAMPT
SCHEMBL30270551 0.86 AURKA (0.57) SMN1; SMN2AURKARPS6KB1NPY1R
SCHEMBL3460916 0.84 KMT2A (0.55) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4922883 0.83 NAMPT (0.63) MAPTNPC1RAB9ASMN1; SMN2MEN1

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-8093266-B2 Rho kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-10 US disclosed
US-20100041645-A1 RHO KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-02-18 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-20100041645-A1 RHO KINASE INHIBITORS CIT, ROCK1, RHOT2 MAPT 395/4885CCKBR 3984/4885NPC1 3330/4885

“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.