SCHEMBL23719175

SCHEMBL23719175

O=C(Nc1ccccc1)Nc1cn(-c2ccccc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ ADORA3 P0DMS8 2/20 0.54
▸ PIM1 P11309 2/20 0.54
▸ ADORA2A P29274 1/20 0.54
▸ ADORA2B P29275 1/20 0.54
▸ ADORA1 P30542 1/20 0.54
▸ FLT3 P36888 1/20 0.54
▸ PIM3 Q86V86 1/20 0.54
▸ AURKB Q96GD4 1/20 0.54
▸ TSHR P16473 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ EPHX1 P07099 1/20 0.52
▸ EPHX2 P34913 1/20 0.52
▸ CDK9 P50750 1/20 0.52
▸ CLK4 Q9HAZ1 1/20 0.52
▸ TAAR1 Q96RJ0 2/20 0.47
▸ OTUD7B Q6GQQ9 1/20 0.47
▸ CPB1 P15086 1/20 0.47

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
SCHEMBL22828679 0.84 KMT2A (0.54) NPC1RAB9ACPB1KMT2AMEN1
SCHEMBL23719173 0.83 CPB1 (0.43) NPC1RAB9ASMN1; SMN2EPHX1OTUD7B
SCHEMBL27567730 0.81 HSD17B10 (0.53) NPC1RAB9ASMN1; SMN2ADORA3ADORA2A
SCHEMBL6213955 0.77 OTUD7B (0.46) SMN1; SMN2TP53OTUD7BCPB1KMT2A
SCHEMBL27507812 0.74 SMN1; SMN2 (0.59) NPC1RAB9ASMN1; SMN2ADORA3TSHR
SCHEMBL22246719 0.72 NR2E1 (0.55) NPC1RAB9AADORA3OTUD7BUSP30
Diphenylurea SCHEMBL133103 0.72 SMN1; SMN2 (1.00) NPC1RAB9ASMN1; SMN2TSHRTP53
SCHEMBL19375825 0.72 ACVR1 (0.41) NPC1RAB9AOTUD7BCPB1USP30
SCHEMBL23719194 0.71 MAPT (0.68) NPC1RAB9ASMN1; SMN2ADORA3PIM1
SCHEMBL9317689 0.70 RAB9A (1.00) NPC1RAB9ASMN1; SMN2ADORA3PIM1

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-20210236466-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2021-08-05 — — 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-20210236466-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 NPC1 859/4885RAB9A 876/4885SMN1; SMN2 2298/4885

“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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