SCHEMBL11348193

SCHEMBL11348193

NCCCNc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 11/20 0.55
STK17B O94768 6/20 0.53
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FERMT2 Q96AC1 1/20 0.45
RHOC P08134 1/20 0.45
RHOA P61586 1/20 0.45
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PRSS1 P07477 2/20 0.42

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
SCHEMBL11935538 0.92 STK17A (0.52) STK17ASTK17BMEN1KMT2AFERMT2
SCHEMBL4023262 0.92 STK17A (0.52) STK17ASTK17BMEN1KMT2AFERMT2
SCHEMBL11748511 0.89 MAPT (0.52) STK17AMAPTALDH1A1PRSS1
SCHEMBL656024 0.86 STK17A (0.50) STK17ASTK17BMEN1KMT2AFERMT2
SCHEMBL9639726 0.86 MAPT (0.55) MEN1KMT2ARHOCRHOAMAPT
Hydrochloric Acid SCHEMBL28709080 0.84 STK17A (0.49) STK17ASTK17BMEN1KMT2AFERMT2
SCHEMBL7425672 0.80 STK17A (0.51) STK17ASTK17BMAPTALDH1A1PRSS1
SCHEMBL908984 0.80 RHOC (0.46) STK17ASTK17BMEN1KMT2ARHOC
SCHEMBL9155154 0.80 APP (0.52) STK17AMAPTALDH1A1PRSS1
SCHEMBL3029679 0.79 MEN1 (0.47) MEN1KMT2ARHOCRHOAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120252792-A1 METHODS AND COMPOSITIONS FOR MODULATING RHO-MEDIATED GENE TRANSCRIPTION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
US-20120252792-A1 METHODS AND COMPOSITIONS FOR MODULATING RHO-MEDIATED GENE TRANSCRIPTION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-10-04 US disclosed
WO-2011035143-A2 METHODS AND COMPOSITIONS FOR INHIBITING RHO-MEDIATED DISEASES AND CONDITIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-03-24 WO disclosed
US-4264494-A Chromium complex dyestuffs for natural polyamides and synthetic nylons BASF AKTIENGESELLSCHAFT (DE) 1981-04-28 US disclosed
US-4212801-A Unsymmetrical 1:2-chromium complexes containing an azo and an azomethine bond BASF AKTIENGESELLSCHAFT (DE) 1980-07-15 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-20120252792-A1 METHODS AND COMPOSITIONS FOR MODULATING RHO-MEDIATED GENE TRANSCRIPTION RHOA, RHOC, ROCK1 STK17A 2930/4885STK17B 2975/4885MEN1 3849/4885

“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.