SCHEMBL16769413

SCHEMBL16769413

Cc1cc(C)c(-c2ccc(-c3nc(-c4ccc(-c5c(C)cc(C)cc5C)cc4)nc(-c4ccc(C(C)(C)C)cc4)n3)cc2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.42
KIF11 P52732 1/20 0.40
XDH P47989 1/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 3/20 0.40
HPGD P15428 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LCK P06239 1/20 0.38
KIT P10721 1/20 0.38
SRC P12931 1/20 0.38
KDR P35968 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 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
SCHEMBL16769425 0.95 NPC1 (0.44) NPC1RAB9AALDH1A1TSHRXDH
SCHEMBL16769427 0.94 NPC1 (0.46) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL16769414 0.94 NPC1 (0.46) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL16769406 0.90 NPC1 (0.43) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL12622302 0.89 NPC1 (0.48) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL5953676 0.89 TSHR (0.52) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL16769403 0.88 NPC1 (0.44) NPC1RAB9AALDH1A1TSHRMAPT
SCHEMBL12622296 0.87 L3MBTL1 (0.41) NPC1RAB9AALDH1A1MAPTHPGD
SCHEMBL15158558 0.84 NPC1 (0.56) NPC1RAB9AALDH1A1TSHRKIF11
SCHEMBL15025688 0.83 ADORA3 (0.40) NPC1RAB9AALDH1A1MAPTLMNA

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-9853218-B2 High-molecular compound and light-emitting element using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-12-26 US disclosed
US-20150155495-A1 HIGH-MOLECULAR COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-04 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-20150155495-A1 HIGH-MOLECULAR COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME ARL1, CCNL2, CRKL NPC1 4029/4885RAB9A 825/4885ALDH1A1 806/4885

“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.