SCHEMBL10272929

SCHEMBL10272929

CCc1cnc2ccc(OC)cc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 3/20 0.51
POLB P06746 3/20 0.51
RAB9A P51151 3/20 0.51
KMT2A Q03164 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 2/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
NQO2 P16083 1/20 0.51
PDGFRB P09619 6/20 0.51
PDGFRA P16234 6/20 0.51
EGFR P00533 2/20 0.46
HPGDS O60760 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
HPGD P15428 2/20 0.44
F2 P00734 1/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 2/20 0.42
THRB P10828 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
SCHEMBL10272593 0.93 ALDH1A1 (0.51) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL29234078 0.79 PDGFRB (0.50) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL10271472 0.77 NQO2 (0.47) ALDH1A1MEN1RAB9AKMT2ASMN1; SMN2
SCHEMBL12844007 0.77 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KDM4ENQO2PDGFRB
SCHEMBL14970152 0.77 ALDH1A1 (0.56) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL23651807 0.76 ALDH1A1 (0.55) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL17179175 0.76 FGFR3 (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL559347 0.76 ALDH1A1 (0.55) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL621383 0.76 ALDH1A1 (0.55) ALDH1A1MEN1POLBRAB9AKMT2A
SCHEMBL17179171 0.76 HTT (0.41) ALDH1A1MEN1KMT2AHPGDMAPT

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-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands BRISTOL-MYERS SQUIBB COMPANY 2012-02-09 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-20120035189-A1 Quinuclidine Compounds as Alpha-7 Nicotinic Acetylcholine Receptor Ligands CHRNA7, CHRNA5, CHRNA6 ALDH1A1 1082/4885MEN1 3838/4885POLB 2083/4885

“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.