SCHEMBL23079842

SCHEMBL23079842

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6nc(-c7ccc(-c8nc9ccccc9o8)cc7)nc(-c7ccc(-c8nc9ccccc9o8)cc7)n6)cc5)ccc43)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 8/20 0.46
▸ RAB9A P51151 6/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ATM Q13315 1/20 0.46
▸ KDM4E B2RXH2 7/20 0.41
▸ HPGD P15428 7/20 0.41
▸ SMN1; SMN2 Q16637 7/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ HSD17B10 Q99714 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ CASP3 P42574 3/20 0.41
▸ SENP7 Q9BQF6 3/20 0.41
▸ SENP6 Q9GZR1 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ USP2 O75604 2/20 0.41
▸ SENP8 Q96LD8 2/20 0.41
▸ HCRTR1 O43613 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41

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
SCHEMBL23079978 0.98 NPC1 (0.46) NPC1RAB9AMEN1KMT2AATM
SCHEMBL23079835 0.97 NPC1 (0.47) NPC1RAB9AMEN1KMT2AATM
SCHEMBL23079883 0.97 NPC1 (0.47) NPC1RAB9AMEN1KMT2AATM
SCHEMBL23118533 0.97 NPC1 (0.44) NPC1RAB9AMEN1KMT2AATM
SCHEMBL23080008 0.97 NPC1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10065374 0.96 NPC1 (0.48) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10065286 0.96 NPC1 (0.48) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10065178 0.96 NPC1 (0.48) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10065282 0.96 NPC1 (0.48) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10065366 0.96 NPC1 (0.48) NPC1RAB9AMEN1KMT2AATM

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-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2021-03-11 — — 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-20210070717-A1 ORGANIC COMPOUND BASED ON TRIAZINE AND BENZOXAZOLE AND APPLICATION THEREOF IN ORGANIC ELECTROLUMINESCENT DEVICE OCIAD1, EED, OCIAD2 NPC1 3199/4885RAB9A 3258/4885MEN1 4875/4885

“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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