SCHEMBL4846015

SCHEMBL4846015

CCc1ccc(C(=O)Nc2cccc(C(=O)/C=C3\NC(C)(C)Cc4ccc(OC)cc43)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.44
RAB9A P51151 6/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
TP53 P04637 4/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
KCNK9 Q9NPC2 2/20 0.43
KCNA5 P22460 5/20 0.42
NLRP3 Q96P20 1/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.41
KCNK3 O14649 3/20 0.41
BCHE P06276 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
SCHEMBL4846022 1.00 NPC1 (0.44) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4844038 0.94 ABCG2 (0.45) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4844026 0.94 ABCG2 (0.45) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4846336 0.93 TP53 (0.48) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4846328 0.93 TP53 (0.48) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4837674 0.92 PLK1 (0.43) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4837689 0.92 PLK1 (0.43) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4844969 0.92 NPC1 (0.48) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4844982 0.92 NPC1 (0.48) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL4835293 0.92 KCNA5 (0.41) NPC1RAB9ASMN1; SMN2TP53KMT2A

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-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 NPC1 985/4885RAB9A 2220/4885SMN1; SMN2 144/4885

“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.