SCHEMBL14725751

SCHEMBL14725751

COc1ccc(-c2cc3cc4c(cc(-c5ccc(C)cc5)c5cc6c(cc54)sc4ccccc46)cc3c3cc4sc5ccccc5c4cc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
MAPK1 P28482 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ACACA Q13085 1/20 0.42
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 2/20 0.41

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
SCHEMBL14727526 0.95 NPC1 (0.48) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472917 0.93 NPC1 (0.48) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472869 0.86 NPC1 (0.44) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472667 0.85 PTPN1 (0.43) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472831 0.83 KDM4E (0.40) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL15461861 0.83 MAPT (0.46) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472725 0.81 ACACA (0.38) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL16472932 0.81 KDM4E (0.40) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL14725745 0.80 GPR3 (0.45) RAB9AMAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL14725644 0.80 ALDH1A1 (0.44) NPC1RAB9AMAPTALDH1A1SMN1; 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-9255084-B2 Heterocyclic compound and organic light-emitting device containing the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-02-09 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 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-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME TRPC1, TRPC4, TRPC6 NPC1 1953/4885RAB9A 1964/4885MAPT 717/4885

“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.