SCHEMBL111145

SCHEMBL111145

COC(=O)c1cc(-c2ccc(OC)c(F)c2)nc(-c2ccc(C)cc2)c1N

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.48
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
PLA2G2A P14555 2/20 0.43
PIM1 P11309 2/20 0.41
KDR P35968 1/20 0.41
CTSA P10619 3/20 0.41
PRKCZ Q05513 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NEK2 P51955 2/20 0.40
POLB P06746 1/20 0.40
JAK2 O60674 2/20 0.40

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
SCHEMBL141481 0.91 DHODH (0.48) DHODHALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL110884 0.83 PLA2G2A (0.59) DHODHALDH1A1MEN1KMT2AKDM4E
SCHEMBL15976010 0.82 DHODH (0.41) DHODHALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL140353 0.78 PLA2G2A (0.64) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL109071 0.75 CA12 (0.42) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4602311 0.74 KDM4E (0.62) DHODHALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL29707061 0.74 DHODH (0.47) DHODHALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL22981957 0.74 DHODH (0.47) DHODHALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL15976449 0.74 DHODH (0.41) DHODHALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL1926175 0.71 MAPT (0.55) DHODHNPC1RAB9ASMN1; SMN2MEN1

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 DHODH 3348/4885ALDH1A1 1464/4885NPC1 2156/4885

“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.