SCHEMBL10330651

SCHEMBL10330651

Cc1ccc2cc(C(=O)Nc3cccc(C(=O)O)c3)c(=O)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ NPC1 O15118 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 6/20 0.50
▸ CA12 O43570 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ MEN1 O00255 5/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ CREBBP Q92793 1/20 0.47
▸ ITK Q08881 1/20 0.47
▸ MAPT P10636 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ NHERF1 O14745 2/20 0.47
▸ THRB P10828 1/20 0.46
▸ F12 P00748 1/20 0.46
▸ MAOB P27338 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
SCHEMBL10330656 0.89 GPR17 (0.54) SMN1; SMN2NPC1RAB9AHTTKMT2A
SCHEMBL10330642 0.77 DAO (0.63) SMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL13964393 0.76 SORT1 (0.65) NR1H4SMN1; SMN2NPC1RAB9AHTT
SCHEMBL21639644 0.76 CA12 (0.48) NR1H4SMN1; SMN2NPC1RAB9AHTT
SCHEMBL21674069 0.76 MEN1 (0.47) NR1H4SMN1; SMN2NPC1RAB9AHTT
SCHEMBL14363294 0.75 NPC1 (0.60) NR1H4SMN1; SMN2NPC1RAB9AHTT
SCHEMBL6168742 0.73 NPC1 (0.66) SMN1; SMN2NPC1RAB9ATP53F12
SCHEMBL30395353 0.73 NPC1 (0.66) SMN1; SMN2NPC1RAB9ATP53F12
SCHEMBL21639712 0.73 MAOA (0.58) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL7696259 0.73 NR1H4 (0.56) NR1H4SMN1; SMN2NPC1RAB9AHTT

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-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES LUK KIN-CHUN (US) 2012-07-19 — — 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-20120184562-A1 1,6- AND 1,8-NAPHTHYRIDINES PSEN1, BRCA1, PSEN2 NR1H4 2490/4885SMN1; SMN2 23/4885NPC1 29/4885

“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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