SCHEMBL23016178

SCHEMBL23016178

c1cnc2c(-c3ccc4cc(-c5ccc6nc(-c7ccc(-c8ccnc9c8ccc8cccnc89)cc7)ccc6c5)ccc4n3)cccc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
POLB P06746 1/20 0.42
CCR1 P32246 2/20 0.41
CCR5 P51681 2/20 0.41
CCR8 P51685 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TOP1 P11387 6/20 0.39
LMNA P02545 2/20 0.38
BRD4 O60885 1/20 0.37
MMP9 P14780 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
TP53 P04637 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP2 P08253 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 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
SCHEMBL23016087 0.94 NPC1 (0.45) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016197 0.92 TOP1 (0.40) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016194 0.91 NPC1 (0.42) NPC1RAB9APOLBCCR1CCR5
SCHEMBL24475701 0.91 NPC1 (0.42) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016179 0.91 NPC1 (0.42) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016261 0.91 TOP1 (0.50) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016311 0.91 NPC1 (0.51) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016227 0.91 NPC1 (0.44) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016174 0.89 TOP1 (0.49) NPC1RAB9APOLBCCR1CCR5
SCHEMBL23016245 0.89 TOP1 (0.46) NPC1RAB9APOLBCCR1CCR5

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-10930857-B2 Heterocyclic compound and organic light emitting device using same LT MATERIALS CO., LTD. (KR) 2021-02-23 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-10930857-B2 Heterocyclic compound and organic light emitting device using same CRY1, CRY2, CYBA NPC1 4299/4885RAB9A 3913/4885POLB 699/4885

“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.