SCHEMBL10836775

SCHEMBL10836775

CC(=O)N(C)CCP(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
ACHE P22303 1/20 0.40
CXCR3 P49682 1/20 0.39
KMT2A Q03164 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
TSPO P30536 1/20 0.36
KDM1A O60341 1/20 0.35
KDM4E B2RXH2 2/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
MEN1 O00255 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL12313464 0.84 ALDH1A1 (0.35) MTNR1AMTNR1BKMT2AALDH1A1MEN1
SCHEMBL5034935 0.77 ALDH1A1 (0.35) MTNR1AMTNR1BKMT2AKDM4EUSP2
SCHEMBL3164447 0.77 TAAR1 (0.46) KMT2AKDM4EALDH1A1OPRM1MEN1
Acetic Acid SCHEMBL30885078 0.77 ALDH1A1 (0.39) KMT2AKDM4EALDH1A1MEN1
SCHEMBL1466090 0.77 SIGMAR1 (0.39) KMT2AALDH1A1
Acetic Acid SCHEMBL1075968 0.77 ALDH1A1 (0.39) KMT2AKDM4EALDH1A1MEN1
Acetic Acid SCHEMBL9803960 0.77 ALDH1A1 (0.39) KMT2AKDM4EALDH1A1MEN1
SCHEMBL12337516 0.76 MEN1 (0.36) KMT2ANPC1RAB9AKDM4EALDH1A1
Acetic Acid SCHEMBL9296547 0.75 ALDH1A1 (0.38) CA12CA9KDM4EALDH1A1
SCHEMBL10728992 0.73 ALDH1A1 (0.50) KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0130085-B1 PROCESS FOR THE PRODUCTION OF GLYCOL ALDEHYDE AND CATALYST THEREFOR THE HALCON SD GROUP, INC. (US) 1986-08-20 EP claimed
EP-0130085-A1 Process for the production of glycol aldehyde and catalyst therefor THE HALCON SD GROUP, INC. (US) 1985-01-02 EP claimed
US-4608444-A Process and accompanying catalysts for the hydroformylation of formaldehyde to glycol-aldehyde THE HALCON SD GROUP, INC. (US) 1986-08-26 US disclosed
EP-0130085-B1 PROCESS FOR THE PRODUCTION OF GLYCOL ALDEHYDE AND CATALYST THEREFOR THE HALCON SD GROUP, INC. (US) 1986-08-20 EP disclosed
US-4560806-A Process and catalyst useful in the production of glycol aldehyde THE HALCON SD GROUP, INC. (US) 1985-12-24 US disclosed
EP-0158518-A2 Process and accompanying catalysts for the hydroformylation of formaldehyde to glycol aldehyde Montvale Process Company Incorporated (US) 1985-10-16 EP disclosed
EP-0130085-A1 Process for the production of glycol aldehyde and catalyst therefor THE HALCON SD GROUP, INC. (US) 1985-01-02 EP disclosed