SCHEMBL14046217

SCHEMBL14046217

Cc1nc2ccc(C(C)C)nc2s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.38
▸ NPC1 O15118 5/20 0.36
▸ RAB9A P51151 5/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ GAA P10253 1/20 0.34
▸ TDP1 Q9NUW8 3/20 0.33
▸ HTT P42858 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LDHA P00338 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SCN4A P35499 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ PDE2A O00408 1/20 0.30

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
SCHEMBL25804780 0.85 SMN1; SMN2 (0.36) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL30521211 0.85 SMN1; SMN2 (0.36) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL798776 0.81 ACACB (0.36) SMN1; SMN2NPC1RAB9ASCN4A
SCHEMBL19939687 0.79 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL25805373 0.78 SMN1; SMN2 (0.36) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL31003297 0.78 SMN1; SMN2 (0.33) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL13201318 0.77 LDHA (0.37) NPC1RAB9AALDH1A1MAPTLDHA
SCHEMBL30770739 0.76 SMN1; SMN2 (0.40) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL17253548 0.76 SMN1; SMN2 (0.40) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL805088 0.75 SMN1; SMN2 (0.42) SMN1; SMN2NPC1RAB9AALDH1A1MAPT

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
WO-2021160132-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海美悦生物科技发展有限公司 2021-08-19 — — WO disclosed
US-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors SIRTRIS PHARMACEUTICALS, INC. (US) 2008-10-09 — — 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-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors MTTP, CETP, FABP2 SMN1; SMN2 4591/4885NPC1 37/4885RAB9A 2515/4885

“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.

Send feedback