SCHEMBL10193135

SCHEMBL10193135

Cc1ccn(-c2cc(B(O)O)c3cccnc3n2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
JAK2 O60674 1/20 0.38
TYK2 P29597 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
IDO1 P14902 6/20 0.36
ADORA2A P29274 3/20 0.35
GRM4 Q14833 1/20 0.34
DHODH Q02127 1/20 0.32
CCR1 P32246 1/20 0.31
CCR8 P51685 1/20 0.31
PDE10A Q9Y233 1/20 0.31
CYP1A2 P05177 1/20 0.31
GRIA1 P42261 1/20 0.31

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
SCHEMBL3405607 0.83 L3MBTL1 (0.46) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL12424756 0.76 TGFBR1 (0.41) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL2328238 0.73 NPC1 (0.37) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL3382263 0.71 IKBKE (0.50) IDO1IGF1R
SCHEMBL243473 0.69 CCR1 (0.46) DHODHCCR1CCR8
SCHEMBL2563617 0.67 RAB9A (0.69) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL38651177 0.67 MAPT (0.63) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL1907360 0.67 MAPT (0.63) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL3660220 0.67 RAB9A (0.50) MAPTRAB9ANPC1ATMSMN1; SMN2
SCHEMBL17540994 0.66 HSP90AA1 (0.39) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
WO-2012000595-A1 2,4- DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2012-01-05 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-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER TGFBR1, TAB1, TGFBR2 MAPT 4149/4885RAB9A 2544/4885NPC1 2454/4885

“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.