SCHEMBL110326

SCHEMBL110326

COC(=O)c1cc(-c2ccc(OC)c(F)c2)nc2c3ccc(Cl)cc3n(Cc3ccc(C)cc3)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.40
PLA2G2A P14555 1/20 0.39
JAK2 O60674 2/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PPARG P37231 1/20 0.38
PTGES2 Q9H7Z7 2/20 0.38
DHODH Q02127 2/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DRD2 P14416 1/20 0.37
TBXA2R P21731 1/20 0.37
PTGES O14684 1/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL141523 0.94 PLA2G2A (0.47) P2RX3PLA2G2AJAK2DHODHMAPT
SCHEMBL109351 0.86 L3MBTL1 (0.41) PLA2G2AGAANPSR1L3MBTL1DHODH
SCHEMBL143205 0.81 PLA2G2A (0.49) PLA2G2AGAAMAPTLMNAKDM4E
SCHEMBL110330 0.80 L3MBTL1 (0.46) PLA2G2AGAANPSR1L3MBTL1MAPT
SCHEMBL143786 0.78 JAK2 (0.52) PLA2G2AJAK2L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL142075 0.78 PLA2G2A (0.46) PLA2G2AJAK2GAAMAPTLMNA
SCHEMBL145790 0.74 CCR2 (0.46) PLA2G2AGAAMAPTLMNAKDM4E
SCHEMBL142452 0.74 JAK2 (0.58) PLA2G2AJAK2GAADHODHKDM4E
SCHEMBL1924784 0.71 MEN1 (0.46) P2RX3MAPTLMNAKDM4ENPC1
SCHEMBL110216 0.69 JAK2 (0.39) P2RX3JAK2NPSR1ALDH1A1SMN1; 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 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 P2RX3 3501/4885PLA2G2A 4509/4885JAK2 1/4885

“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.