SCHEMBL2268176

SCHEMBL2268176

CCc1ccc(CC2CNc3ccc(Cl)cc3C(c3ccc(O)cc3)=N2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 9/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
CCKBR P32239 2/20 0.38
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL2269267 0.92 MEN1 (0.39) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2265725 0.91 CHRM1 (0.41) CHRM1MEN1KMT2ALMNAALB
SCHEMBL3231240 0.90 CHRM1 (0.38) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2267540 0.90 CCKBR (0.41) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2264526 0.86 CHRM1 (0.44) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2268380 0.85 CCKBR (0.41) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2268056 0.81 CCKBR (0.55) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2268675 0.81 MEN1 (0.43) CHRM1MEN1KMT2ALMNAALB
SCHEMBL2267642 0.81 LMNA (0.44) CHRM1MEN1KMT2ALMNAALB
SCHEMBL3226742 0.81 CHRM1 (0.39) CHRM1MEN1KMT2ALMNAALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289498-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-11-15 US disclosed
US-8242109-B2 Compositions and methods relating to novel compounds and targets thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-08-14 US disclosed
US-20110195959-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2011-08-11 US disclosed
US-7851465-B2 Compositions and methods relating to novel compounds and targets thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-12-14 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 (2 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-20110195959-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof BAX, BAD, BAK1 CHRM1 2574/4885MEN1 4283/4885KMT2A 4111/4885
US-20120289498-A1 Compositions And Methods Relating To Novel Compounds And Targets Thereof BAX, BAD, BAK1 CHRM1 2574/4885MEN1 4283/4885KMT2A 4111/4885

“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.