SCHEMBL16170237

SCHEMBL16170237

Cc1ccc2c(c1)C(=O)C1(CCCCC1)N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.44
ROS1 P08922 1/20 0.44
CDK5 Q00535 1/20 0.44
ACVR1 Q04771 1/20 0.44
LRRK2 Q5S007 1/20 0.44
EPHX2 P34913 1/20 0.44
PDE7A Q13946 8/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 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
SCHEMBL11534209 0.93 ALDH1A1 (0.47) POLBKDM4EALDH1A1MAPTHPGD
SCHEMBL16163174 0.81 PDE7A (0.62) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL16170247 0.77 ALDH1A1 (0.53) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL16163017 0.77 PDE7A (0.54) POLBKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11538334 0.74 CES1 (0.53) MAPTLRRK2PDE7A
SCHEMBL30740464 0.74 CA1 (0.42) ALDH1A1MAPTKMT2ALRRK2CA1
SCHEMBL11539506 0.73 ALDH1A1 (0.57) KDM4EALDH1A1MAPTHPGDKMT2A
SCHEMBL16170250 0.71 KDM4E (0.47) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL14773646 0.71 CA1 (0.44) KDM4EALDH1A1HTTCDK5PDE7A
SCHEMBL16170245 0.70 ALDH1A1 (0.46) KDM4EALDH1A1MAPTHPGDHSD17B10

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-9145364-B2 Synthesis of psuedo indoxyl derivatives COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-29 US disclosed
US-20140309434-A1 SYNTHESIS OF PSUEDO INDOXYL DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-10-16 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-20140309434-A1 SYNTHESIS OF PSUEDO INDOXYL DERIVATIVES IPO4, IPO11, IDO2 POLB 2683/4885KDM4E 1188/4885ALDH1A1 2135/4885

“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.