SCHEMBL24475412

SCHEMBL24475412

c1ccc(-c2cc(-c3ccccn3)cc(-c3ccc4cc(-c5ccc6ccc(-c7ccc8ccc9cccnc9c8n7)nc6c5)ccc4n3)c2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
POLB P06746 1/20 0.43
TGFBR1 P36897 1/20 0.39
KDM4E B2RXH2 5/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
CYP3A4 P08684 3/20 0.38
TP53 P04637 3/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 3/20 0.38
CYP2D6 P10635 2/20 0.38
TSHR P16473 2/20 0.38
GMNN O75496 2/20 0.38
THPO P40225 2/20 0.38
PMP22 Q01453 2/20 0.38
NFKB1 P19838 2/20 0.38
HSP90AA1 P07900 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL24475512 0.98 NPC1 (0.43) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL23016137 0.96 NPC1 (0.46) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24475496 0.95 NPC1 (0.41) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24475673 0.95 KDM4E (0.42) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24475386 0.94 NPC1 (0.42) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24475578 0.94 NPC1 (0.46) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL18943943 0.94 NPC1 (0.46) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL22281607 0.93 NPC1 (0.41) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24475588 0.93 NPC1 (0.43) NPC1RAB9APOLBTGFBR1KDM4E
SCHEMBL24454307 0.93 KDM4E (0.40) NPC1RAB9APOLBTGFBR1KDM4E

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-20220173329-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE LT MATERIALS CO., LTD. (KR) 2022-06-02 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-20220173329-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE OXER1, OCIAD1, OR10J3 NPC1 953/4885RAB9A 2499/4885POLB 3997/4885

“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.