SCHEMBL10193085

SCHEMBL10193085

CC(=O)c1ccc2c(c1)CCCC2=O

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.65
MAOA P21397 3/20 0.59
MAOB P27338 3/20 0.59
PRKCI P41743 1/20 0.59
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
MAPT P10636 1/20 0.58
HSD17B1 P14061 3/20 0.53
CYP2A6 P11509 1/20 0.47
GRM5 P41594 1/20 0.46
MAPK14 Q16539 5/20 0.45
S100A4 P26447 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL8253223 0.89 NPC1 (0.61) BAZ2BMAOAMAOBPRKCINPC1
SCHEMBL18159338 0.86 NPC1 (0.53) BAZ2BMAOAMAOBPRKCINPC1
SCHEMBL29546005 0.84 ALDH1A1 (0.65) BAZ2BMAOAMAOBPRKCIMAPT
SCHEMBL356493 0.84 ALDH1A1 (0.65) BAZ2BMAOAMAOBPRKCIMAPT
SCHEMBL9944562 0.83 MAOA (0.59) BAZ2BMAOAMAOBPRKCIHSD17B1
SCHEMBL10436091 0.83 MAOA (0.59) BAZ2BMAOAMAOBPRKCIHSD17B1
SCHEMBL1090221 0.83 MAOA (0.59) BAZ2BMAOAMAOBPRKCIHSD17B1
SCHEMBL30853876 0.83 MAOA (0.59) BAZ2BMAOAMAOBPRKCIHSD17B1
SCHEMBL19029127 0.82 BAZ2B (0.56) BAZ2BMAOAMAOBPRKCIMAPT
SCHEMBL353895 0.82 BAZ2B (0.56) BAZ2BMAOAMAOBPRKCINPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108299169-B Synthesis method of 6-chloro-3, 4-dihydro-2H-1-naphthalenone 南京杰运医药科技有限公司 2021-04-30 CN disclosed
US-20120035131-A1 PYRAZOLINE COMPOUNDS PFIZER INC 2012-02-09 US disclosed
WO-2011018170-A2 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2011-02-17 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 (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-20120035131-A1 PYRAZOLINE COMPOUNDS F12, CYP3A7, ABCG2 BAZ2B 908/4885MAOA 469/4885MAOB 134/4885

“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.