SCHEMBL952140

SCHEMBL952140

CCn1cc(C(N)=O)c(C)n1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
NAMPT P43490 1/20 0.49
ALDH1A1 P00352 6/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.45
HTT P42858 2/20 0.45
KDM4E B2RXH2 6/20 0.42
NPC1 O15118 2/20 0.42
GAA P10253 2/20 0.42
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 2/20 0.41
COMT P21964 1/20 0.39
POLB P06746 2/20 0.38
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.37
JAK3 P52333 1/20 0.36

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
SCHEMBL954236 0.83 L3MBTL1 (0.56) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL334433 0.83 NAMPT (0.54) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL22979377 0.82 NAMPT (0.57) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL22976065 0.81 ALDH1A1 (0.51) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL952167 0.81 SMN1; SMN2 (0.45) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL6971478 0.81 ACHE (0.39) L3MBTL1NAMPTALDH1A1LMNAHTT
SCHEMBL12486040 0.80 L3MBTL1 (0.43) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL4239294 0.80 NAMPT (0.45) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2
SCHEMBL26419226 0.80 ADORA3 (0.39) L3MBTL1NAMPTALDH1A1LMNAKDM4E
SCHEMBL23273647 0.79 L3MBTL1 (0.47) L3MBTL1NAMPTALDH1A1LMNASMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN disclosed
WO-2023192901-A9 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-14 WO disclosed
WO-2023192901-A1 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-10-05 WO disclosed
US-9139589-B2 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-9090601-B2 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
EP-2391619-A1 HETEROARYLS AND THEIR USE AS PI3K INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2011-12-07 EP disclosed
US-20110003807-A1 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-01-06 US disclosed
US-20110003806-A1 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-01-06 US disclosed
WO-2010090716-A1 HETEROARYLS AND THEIR USE AS PI3K INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-08-12 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 (2 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-20110003807-A1 Thiazole derivatives MTOR, RICTOR, AKT2 L3MBTL1 2095/4885NAMPT 328/4885ALDH1A1 1687/4885
US-20110003806-A1 Heteroaryls and uses thereof RICTOR, MTOR, AKT1S1 L3MBTL1 1465/4885NAMPT 2727/4885ALDH1A1 728/4885

“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.