SCHEMBL2932302

SCHEMBL2932302

Cc1cccnc1Nc1nc2cc(C(=O)O)c(N3CCN(C(C)C)CC3)cc2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F12 P00748 2/20 0.38
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SORT1 Q99523 1/20 0.36
PARP1 P09874 1/20 0.35
TBK1 Q9UHD2 6/20 0.35
ALK Q9UM73 1/20 0.35
PTPN11 Q06124 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL2931752 0.92 LMNA (0.39) LMNAGAAMEN1NPC1MAPT
SCHEMBL2929641 0.91 KCNH2 (0.41) LMNAGAAMEN1NPC1MAPT
SCHEMBL2930571 0.89 OPRL1 (0.38) LMNAGAAMEN1NPC1MAPT
SCHEMBL2930795 0.88 PIK3CA (0.43) LMNAGAAMEN1NPC1MAPT
SCHEMBL2931431 0.88 PRKCQ (0.42) LMNAGAAMEN1NPC1MAPT
SCHEMBL2926394 0.88 PRKCA (0.38) LMNAGAAMEN1NPC1MAPT
SCHEMBL2926396 0.79 RAF1 (0.44) LMNAGAAMAPT
SCHEMBL2930096 0.78 TBK1 (0.35) TBK1
SCHEMBL2929442 0.77 GAA (0.41) LMNAGAAMEN1NPC1MAPT
SCHEMBL2924961 0.75 LMNA (0.39) LMNAGAAMEN1NPC1MAPT

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-8377983-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2013-02-19 US disclosed
US-7820821-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2010-10-26 US disclosed
US-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors TRANSTECH PHARMA, INC. (US) 2010-06-17 US disclosed
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors VTVX HOLDINGS I LLC 2007-09-20 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-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors AURKC, AURKA, AURKB F12 2441/4885LMNA 1520/4885GAA 1732/4885
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors AURKC, AURKA, AURKB F12 2441/4885LMNA 1520/4885GAA 1732/4885

“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.