SCHEMBL9060504

SCHEMBL9060504

CC1N=C(c2ccc(O)cc2)c2cc(Cl)ccc2NC1=O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
MEN1 O00255 1/20 0.59
ALB P02768 1/20 0.59
KMT2A Q03164 1/20 0.59
GABRA1 P14867 1/20 0.59
GABRA5 P31644 1/20 0.59
GABRA3 P34903 1/20 0.59
GABRA2 P47869 1/20 0.59
GABRB2 P47870 1/20 0.59
CHRM1 P11229 6/20 0.57
CCKBR P32239 3/20 0.53
PGR P06401 1/20 0.49

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
SCHEMBL8331379 0.92 CHRM1 (0.62) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL21272248 0.87 CHRM1 (0.74) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL7935883 0.87 CHRM1 (0.74) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL11633050 0.86 LMNA (0.79) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL19585356 0.85 GABRA1 (0.77) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL19585355 0.85 GABRA1 (0.77) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL10203612 0.84 CCKBR (0.61) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL607124 0.80 CCKBR (0.56) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL2268056 0.79 CCKBR (0.55) LMNAMEN1ALBKMT2ACHRM1
SCHEMBL606101 0.79 CCKBR (0.55) LMNAMEN1ALBKMT2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2422788-A2 Benzodiazepines and compositions and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-02-29 EP disclosed
US-20090253686-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-10-08 US disclosed
US-20080293700-A1 Compositions and Methods Relating to Novel Compounds and Targets Thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2008-11-27 US disclosed
WO-2007053193-A2 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-05-10 WO disclosed
US-20070043033-A1 Unsolvated benzodiazepine compositions and methods THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-02-22 US disclosed
US-5545568-A ARRAY OF COMPOUNDS ON SUBSTRATE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-08-13 US disclosed
US-5288514-A Linking a protected 2-aminobenzophenone to a substrate; deprotecting and reacting with an amino acid; cyclization; removal from substrate; screening THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1994-02-22 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 (3 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-20080293700-A1 Compositions and Methods Relating to Novel Compounds and Targets Thereof BAX, BAD, GABRB3 LMNA 2518/4885MEN1 4503/4885ALB 4455/4885
US-20070043033-A1 Unsolvated benzodiazepine compositions and methods GABRA5, GABRA3, GABRA6 LMNA 1390/4885MEN1 3952/4885ALB 2710/4885
US-20090253686-A1 UNSOLVATED BENZODIAZEPINE COMPOSITIONS AND METHODS GABRA5, GABRA3, GABRA6 LMNA 1390/4885MEN1 3952/4885ALB 2710/4885

“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.