SCHEMBL3225440

SCHEMBL3225440

CCCNC1CCC(NCc2cccc(-c3ccncc3)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 4/20 0.56
CARM1 Q86X55 2/20 0.51
ROCK2 O75116 1/20 0.46
ROCK1 Q13464 1/20 0.46
PRKCI P41743 1/20 0.46
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
PARP1 P09874 3/20 0.43
HTR5A P47898 1/20 0.43
MAP4K4 O95819 1/20 0.42
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
EPHX2 P34913 1/20 0.41
KDM4C Q9H3R0 1/20 0.39
CXCR4 P61073 1/20 0.39

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
SCHEMBL12693730 0.84 PRMT6 (0.55) PRMT6CARM1ROCK2ROCK1PRKCI
SCHEMBL14202576 0.84 PRMT6 (0.57) PRMT6CARM1PRKCIMEN1RAB9A
SCHEMBL3236780 0.81 PRMT6 (0.51) PRMT6CARM1PRKCIMEN1RAB9A
SCHEMBL14204501 0.81 PRMT6 (0.54) PRMT6CARM1PRKCIMEN1RAB9A
SCHEMBL17046829 0.79 PRMT6 (0.67) PRMT6ROCK2ROCK1PRKCIEPHX2
SCHEMBL3225438 0.78 ROCK2 (0.58) ROCK2ROCK1
SCHEMBL2095023 0.78 PRMT6 (0.54) PRMT6CARM1PRKCIMEN1RAB9A
SCHEMBL19655691 0.77 PRMT6 (0.64) PRMT6CARM1MEN1RAB9AKMT2A
SCHEMBL11966092 0.76 KDM4D (0.47) PRMT6CARM1ROCK2ROCK1PRKCI
SCHEMBL14204945 0.76 KDM4D (0.47) PRMT6CARM1ROCK2ROCK1PRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242142-B2 Cyclohexylamines, phenylamines and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-08-14 US disclosed
WO-2010022159-A1 CYCLOHEXYLAMINES, PHENYLAMINES AND USES THEREOF BIOSYNERGO (KY) 2010-02-25 WO disclosed
US-20100048637-A1 CYCLOHEXYLAMINES, PHENYLAMINES AND USES THEREOF PEKING UNIVERSITY SHENZHEN GRADUATE SCHOOL (CN) 2010-02-25 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-20100048637-A1 CYCLOHEXYLAMINES, PHENYLAMINES AND USES THEREOF SMO, HNMT, INMT PRMT6 80/4885CARM1 33/4885ROCK2 3493/4885

“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.