SCHEMBL3536077

SCHEMBL3536077

Cc1cc(-c2ccccc2)nc2c[c]ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
MAPT P10636 6/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
THRB P10828 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 5/20 0.46
RAB9A P51151 3/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
AHR P35869 1/20 0.46
LMNA P02545 4/20 0.45
NPC1 O15118 2/20 0.45
HCRTR1 O43613 1/20 0.45
GAA P10253 1/20 0.45
PDGFRB P09619 1/20 0.44
KDR P35968 1/20 0.44
FLT3 P36888 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL951744 0.81 MAPT (0.65) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL30946935 0.80 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL27986152 0.80 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL30388558 0.80 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL17600557 0.80 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6859623 0.80 ALDH1A1 (0.63) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL710469 0.78 ALDH1A1 (0.66) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL15516428 0.76 CYP1A2 (0.55) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL13541765 0.76 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL670646 0.74 CYP1A2 (0.62) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957496-B1 BICYCLIC PROTEIN KINASE INHIBITORS OSI PHARM INC (US) 2012-10-24 EP disclosed
US-7648987-B2 Bicyclic protein kinase inhibitors OSI PHARMACEUTICALS, INC. (US) 2010-01-19 US disclosed
EP-1979353-A2 FUSED HETEROBICYCLIC KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2008-10-15 EP disclosed
US-20070208053-A1 Fused heterobicyclic kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-09-06 US disclosed
WO-2007084667-A2 FUSED HETEROBICYCLIC KINASE INHIBITORS OSI PHARMACEUTICAL, INC. (US) 2007-07-26 WO disclosed
US-20070149521-A1 Bicyclic protein kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-06-28 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-20070149521-A1 Bicyclic protein kinase inhibitors CDK1, MAP4K2, MAP4K3 ALDH1A1 4394/4885MAPT 1073/4885MEN1 3593/4885
US-20070208053-A1 Fused heterobicyclic kinase inhibitors MAP2K5, MAP2K7, MAP2K2 ALDH1A1 4769/4885MAPT 3449/4885MEN1 989/4885

“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.