SCHEMBL7365689

SCHEMBL7365689

O=C(O)n1ncc2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.55
▸ NPC1 O15118 7/20 0.49
▸ RAB9A P51151 7/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ LMNA P02545 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ NFKB2 Q00653 1/20 0.47
▸ RELA Q04206 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ MITF O75030 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ HSD17B10 Q99714 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ CA12 O43570 1/20 0.43

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
SCHEMBL11311967 0.85 PLA2G10 (0.55) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4580147 0.84 PLA2G10 (0.50) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10977450 0.84 PLA2G10 (0.50) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL7366940 0.81 NPC1 (0.50) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL11323086 0.80 ELANE (0.48) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL24754471 0.79 PLA2G10 (0.46) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL11310234 0.78 KDM4E (0.46) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL21431482 0.77 CYP11B2 (0.44) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL31690642 0.77 CYP11B2 (0.44) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL13799918 0.76 RAB9A (0.58) PLA2G10NPC1RAB9ASMN1; SMN2KDM4E

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-20210284613-A1 RADIOLABELLED COMPOUND OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-09-16 — — US disclosed
WO-1995009842-A1 ISOQUINOLINONE-, PHTHALAZINONE-, QUINAZOLINONE- AND BENZOTRIAZOLINONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTI-THROMBOTICS LUITPOLD PHARMA GMBH (DE) 1995-04-13 — — 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-20210284613-A1 RADIOLABELLED COMPOUND PARP3, PARP2, PARP1 PLA2G10 4488/4885NPC1 2451/4885RAB9A 1654/4885

“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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