SCHEMBL109836

SCHEMBL109836

COC(=O)c1cc(Br)nc(-c2ccc(C)nc2)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
CFTR P13569 2/20 0.37
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 2/20 0.37
AXL P30530 1/20 0.37
POLQ O75417 1/20 0.36
SORT1 Q99523 1/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
IKBKE Q14164 1/20 0.35

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
SCHEMBL139273 0.88 MKNK1 (0.45) L3MBTL1KDM4EALDH1A1MAPK1MEN1
SCHEMBL109071 0.85 CA12 (0.42) L3MBTL1KDM4EALDH1A1HPGDMAPT
SCHEMBL139223 0.82 MAPT (0.47) L3MBTL1KDM4EALDH1A1HPGDMAPT
SCHEMBL108830 0.81 PLA2G2A (0.55) KDM4EALDH1A1MAPTRAB9AMEN1
SCHEMBL23958640 0.81 LMNA (0.49) L3MBTL1KDM4EALDH1A1HPGDMAPT
SCHEMBL110319 0.81 MAPT (0.48) L3MBTL1KDM4EALDH1A1MAPTRAB9A
SCHEMBL26276720 0.81 MAPK1 (0.47) ALOX5APCFTRKDM4EALDH1A1MAPT
SCHEMBL110248 0.79 KDM4E (0.42) L3MBTL1KDM4EALDH1A1HPGDMAPT
SCHEMBL110183 0.79 ATR (0.46) KDM4EALDH1A1HPGDMAPTTDP1
SCHEMBL110648 0.77 CA12 (0.47) L3MBTL1KDM4EALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815840-B2 Carbazole and carboline kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-26 US disclosed
US-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-03-08 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-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS JAK2, JAK1, JAK3 ALOX5AP 4120/4885L3MBTL1 2220/4885CFTR 1681/4885

“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.