SCHEMBL17149331

SCHEMBL17149331

Cc1ccc(-n2cnc3ccc(B4OC(C)(C)C(C)(C)O4)cc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HCAR1 Q9BXC0 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 2/20 0.39
MAPK1 P28482 1/20 0.39
MAPK10 P53779 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
GSK3B P49841 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HIF1A Q16665 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
SCHEMBL17149327 0.90 FGFR1 (0.51) FGFR1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL31144717 0.89 FGFR1 (0.45) FGFR1SMN1; SMN2IRAK4HPGDALDH1A1
SCHEMBL14765095 0.88 HTT (0.52) FGFR1HPGDALDH1A1HTTMAPK1
SCHEMBL17137144 0.86 HPGD (0.39) FGFR1HCAR1IRAK4HPGDALDH1A1
SCHEMBL31144629 0.81 ATM (0.41) FGFR1IRAK4HPGDALDH1A1HTT
SCHEMBL3497920 0.80 HTT (0.55) FGFR1HTT
SCHEMBL31144766 0.80 ATM (0.47) HPGDALDH1A1HTTMAPK1MAPK10
SCHEMBL13028373 0.78 DYRK1A (0.42) IRAK4
SCHEMBL29520198 0.78 DYRK1A (0.42) IRAK4
SCHEMBL1129103 0.78 FGFR1 (0.56) FGFR1NPC1RAB9AALDH1A1HTT

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-11834447-B2 Indole derivatives and use thereof PURDUE PHARMA L.P. (US) 2023-12-05 US disclosed
US-20150284383-A1 INDOLE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. 2015-10-08 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 (2 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-11834447-B2 Indole derivatives and use thereof TRPC4, TRPV4, TRPV1 FGFR1 1104/4885NPC1 2946/4885RAB9A 2510/4885
US-20150284383-A1 INDOLE DERIVATIVES AND USE THEREOF TRPC4, TRPV4, TRPV1 FGFR1 1104/4885NPC1 2946/4885RAB9A 2510/4885

“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.