SCHEMBL3249124

SCHEMBL3249124

CC(C)c1ccc(CCCC=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.45
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
IDO1 P14902 2/20 0.41
LMNA P02545 2/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 2/20 0.40
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
FKBP1A P62942 1/20 0.39
UCHL3 P15374 2/20 0.38
USP5 P45974 1/20 0.37
POLB P06746 1/20 0.36
EPHX1 P07099 1/20 0.36
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL3205913 0.94 TYR (0.44) TYRRAB9ANPC1SMN1; SMN2IDO1
SCHEMBL933030 0.88 TYR (0.48) TYRRAB9ANPC1SMN1; SMN2IDO1
SCHEMBL869709 0.88 TYR (0.48) TYRRAB9ANPC1SMN1; SMN2IDO1
SCHEMBL19043222 0.85 LMNA (0.37) RAB9ANPC1SMN1; SMN2LMNAPKM
Propionaldehyde SCHEMBL4619414 0.83 TYR (0.44) TYRRAB9ANPC1SMN1; SMN2IDO1
SCHEMBL19043130 0.82 FFAR1 (0.34) SMN1; SMN2HTTL3MBTL1ALDH1A1S1PR1
SCHEMBL3243515 0.81 ALDH1A1 (0.35) LMNAALDH1A1S1PR1S1PR3KDM4E
SCHEMBL1611924 0.81 IDO1 (0.41) TYRRAB9ANPC1SMN1; SMN2IDO1
SCHEMBL9674964 0.81 GPR84 (0.43) LMNAALDH1A1EPHX1
SCHEMBL6572567 0.79 HDAC4 (0.39) TYRRAB9ANPC1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107074712-B Improvements in or relating to organic compounds 奇华顿股份有限公司 2021-06-29 CN claimed
US-20180282662-A1 Process GIVAUDAN S.A. (CH) 2018-10-04 US claimed
EP-3218459-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan S.A. (CH) 2017-09-20 EP claimed
CN-107074712-A In organic compound or associated improvement 奇华顿股份有限公司 2017-08-18 CN claimed
WO-2016074697-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2016-05-19 WO claimed
EP-3218459-B1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-09-03 EP disclosed
CN-107074712-B Improvements in or relating to organic compounds 奇华顿股份有限公司 2021-06-29 CN disclosed
EP-3218459-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan S.A. (CH) 2017-09-20 EP disclosed
CN-107074712-A In organic compound or associated improvement 奇华顿股份有限公司 2017-08-18 CN disclosed
WO-2016074697-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2016-05-19 WO disclosed
WO-2016074697-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2016-05-19 WO disclosed
WO-2013170072-A2 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NEUROP, INC. (US) 2013-11-14 WO disclosed
WO-2013170072-A2 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NEUROP, INC. (US) 2013-11-14 WO disclosed
EP-1167366-B1 AMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2010-05-05 EP disclosed
US-6562849-B1 Amine compound or pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc. SANKYO COMPANY, LIMITED (JP) 2003-05-13 US disclosed
US-20030078426-A1 Amine derivative compounds SANKYO COMPANY, LIMITED (JP) 2003-04-24 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 (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-20030078426-A1 Amine derivative compounds H1-10, APOB, PRMT1 TYR 380/4885RAB9A 1488/4885NPC1 359/4885
US-20180282662-A1 Process CUL4B, RNF10, BICRA TYR 54/4885RAB9A 1254/4885NPC1 3683/4885

“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.