SCHEMBL14224561

SCHEMBL14224561

CCC1(CC)c2cc(-c3nccc4ccccc34)ccc2-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ S1PR1 P21453 1/20 0.35
▸ HTR2C P28335 2/20 0.34
▸ CYP2A6 P11509 1/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32

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
SCHEMBL13534588 0.91 MAPK14 (0.35) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL13534589 0.80 PDK2 (0.43) NPC1RAB9AKDM4ECYP1A2CYP2C19
SCHEMBL17149214 0.79 PDK2 (0.38) ALDH1A1PDK2
SCHEMBL13372342 0.77 MAPT (0.38) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL13357121 0.77 MAPT (0.38) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL13658652 0.76 ELANE (0.36) MAPTALDH1A1HPGDMAPK1CYP2C19
SCHEMBL13622053 0.75 PDK2 (0.38) CYP2C19PDK2
SCHEMBL18052350 0.75 PDK2 (0.38) CYP2C19PDK2
SCHEMBL14207075 0.75 PDK2 (0.35) PDK2
SCHEMBL14207077 0.75 PDK2 (0.35) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080091021-A1 Diarylaminofluorene-based organometallic phosphors and organic light-emitting devices made with such compounds HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY, THE (CN) 2008-04-17 — — 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-20080091021-A1 Diarylaminofluorene-based organometallic phosphors and organic light-emitting devices made with such compounds ORC3, MCM3, TEC NPC1 4364/4885RAB9A 2955/4885KDM4E 1631/4885

“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.

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