SCHEMBL18943263

SCHEMBL18943263

c1cc(-c2ccc3cc(-c4ccc5nc(-c6cccc(-c7ccc8ccc9cccnc9c8n7)c6)ccc5c4)ccc3n2)cc(-c2ccc3ccc4cccnc4c3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
RAB9A P51151 1/20 0.51
LMNA P02545 2/20 0.46
CCR1 P32246 2/20 0.46
CCR5 P51681 2/20 0.46
CCR8 P51685 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GMNN O75496 1/20 0.46
TP53 P04637 1/20 0.46
HSP90AA1 P07900 1/20 0.46
MMP2 P08253 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
MMP9 P14780 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
MMP8 P22894 1/20 0.46

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
SCHEMBL23016140 0.99 NPC1 (0.50) NPC1POLBRAB9ALMNACCR1
SCHEMBL24475674 0.96 NPC1 (0.47) NPC1POLBRAB9ALMNACCR1
SCHEMBL18943955 0.96 TOP1 (0.50) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016201 0.95 NPC1 (0.46) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016099 0.95 NPC1 (0.46) NPC1POLBRAB9ALMNACCR1
SCHEMBL22282125 0.95 NPC1 (0.46) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016065 0.95 TOP1 (0.49) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016285 0.95 TOP1 (0.49) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016189 0.94 NPC1 (0.45) NPC1POLBRAB9ALMNACCR1
SCHEMBL23016270 0.94 NPC1 (0.46) NPC1POLBRAB9ALMNACCR1

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-10930857-B2 Heterocyclic compound and organic light emitting device using same LT MATERIALS CO., LTD. (KR) 2021-02-23 US disclosed
WO-2017095157-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 희성소재(주) 2017-06-08 WO 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 4299/4885POLB 699/4885RAB9A 3913/4885

“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.