SCHEMBL4363640

SCHEMBL4363640

CNc1cc(Oc2ccc(O)cc2)ccn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCK P35557 3/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
KDR P35968 2/20 0.45
LTA4H P09960 6/20 0.44
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
RIPK2 O43353 1/20 0.40
TGFBR1 P36897 1/20 0.39
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38

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
SCHEMBL4363033 0.81 ALDH1A1 (0.46) GCKMEN1KMT2AKDRRIPK2
SCHEMBL14537934 0.81 BRAF (0.46) GCKKDRRIPK2TGFBR1
SCHEMBL4363922 0.79 GCK (0.51) GCKMEN1KMT2A
SCHEMBL10269256 0.78 GCK (0.47) GCKMEN1KMT2AESR1ESR2
SCHEMBL20040795 0.76 GCK (0.42) GCKMEN1KMT2AKDRRIPK2
SCHEMBL4369170 0.76 GCK (0.42) GCKMEN1KMT2AKDRRIPK2
SCHEMBL2904468 0.75 MEN1 (0.54) MEN1KMT2AESR1ESR2LTA4H
SCHEMBL2028649 0.75 GCK (0.43) GCKKDRRIPK2TGFBR1
SCHEMBL30496425 0.74 CCR1 (0.57) KDR
SCHEMBL3927522 0.74 CCR1 (0.57) KDR

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-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 EP disclosed
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 US disclosed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 WO 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-20040209892-A1 Heterocyclic compounds and methods of use VHL, NQO1, HPGDS GCK 953/4885MEN1 808/4885KMT2A 3750/4885

“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.