SCHEMBL17773239

SCHEMBL17773239

Cc1ccc(NC(=O)C2CCCN(C(=O)c3sc(-c4ccccc4)nc3C)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.53
RAB9A P51151 2/20 0.52
RHOA P61586 5/20 0.51
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
POLB P06746 2/20 0.46
TP53BP1 Q12888 1/20 0.46
TP53 P04637 1/20 0.46
HTR2C P28335 1/20 0.46

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
SCHEMBL17728991 0.93 RHOA (0.60) CNR1RAB9ARHOAALDH1A1LMNA
SCHEMBL17773257 0.83 RHOA (0.55) RAB9ARHOAMEN1KMT2ATP53BP1
SCHEMBL12789540 0.78 CNR1 (0.77) CNR1RAB9AALDH1A1MEN1LMNA
SCHEMBL17773237 0.78 RAB9A (0.52) RAB9ARHOAALDH1A1POLBTP53BP1
SCHEMBL6006050 0.75 CNR1 (0.61) CNR1RAB9AALDH1A1MEN1LMNA
SCHEMBL3456305 0.74 CNR1 (0.66) CNR1RAB9AALDH1A1MEN1LMNA
SCHEMBL17729073 0.74 RHOA (0.61) RHOAALDH1A1LMNAMAPTPOLB
SCHEMBL25668693 0.74 RAB9A (0.72) RAB9ARHOAALDH1A1MAPTPOLB
SCHEMBL17773205 0.74 RAB9A (0.54) RAB9ARHOAALDH1A1MEN1KMT2A
SCHEMBL12790042 0.73 CNR1 (0.72) CNR1ALDH1A1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145251-A1 INHIBITORS OF MYOCARDIN-RELATED TRANSCRIPTION FACTOR AND SERUM RESPONSE FACTOR (MRTF/SRF)-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2016-05-26 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-20160145251-A1 INHIBITORS OF MYOCARDIN-RELATED TRANSCRIPTION FACTOR AND SERUM RESPONSE FACTOR (MRTF/SRF)-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME SREBF1, SREBF2, BPTF CNR1 4590/4885RAB9A 2184/4885RHOA 229/4885

“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.