SCHEMBL9174256

SCHEMBL9174256

CCCCCCCCCCCCNCC(CC)CCCC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.72
TSHR P16473 3/20 0.72
CYP3A4 P08684 2/20 0.72
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
ANPEP P15144 1/20 0.44
ERAP2 Q6P179 1/20 0.44
EPHX1 P07099 2/20 0.40
LMNA P02545 2/20 0.40
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
ADH4 P08319 1/20 0.40
ADH7 P40394 1/20 0.40
DNM1 Q05193 2/20 0.39
S1PR2 O95136 5/20 0.37
S1PR4 O95977 5/20 0.37
S1PR1 P21453 5/20 0.37
S1PR3 Q99500 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL26034630 1.00 ALDH1A1 (0.72) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL9204886 1.00 ALDH1A1 (0.72) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL28697359 1.00 ALDH1A1 (0.72) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL2949453 1.00 ALDH1A1 (0.72) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL11663392 1.00 ALDH1A1 (0.72) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL7785935 0.98 ALDH1A1 (0.75) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL11663393 0.96 ALDH1A1 (0.65) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL20627942 0.96 ALDH1A1 (0.65) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL11660748 0.96 ALDH1A1 (0.65) ALDH1A1TSHRCYP3A4KDM4ETDP1
SCHEMBL23643890 0.94 ALDH1A1 (0.68) ALDH1A1TSHRCYP3A4KDM4ETDP1

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-103865611-A LUBRICATING OIL COMPOSITIONS CONTAINING STERICALLY HINDERED AMINES AS ASHLESS TBN SOURCES INFINEUM INT LTD 2014-06-18 CN disclosed
CN-100343442-C Tackifier for printing paste and composition for printing paste containing the same ASAHI KAGAKU KOGYO CO LTD (JP) 2007-10-17 CN disclosed
CN-1412380-A Tackifier for printing paste and composition for printing paste containing the same ASAHI KAGAKU KOGYO CO LTD (JP) 2003-04-23 CN disclosed
EP-0556297-B1 PROCESS FOR PRODUCING IMINES AND/OR AMINES FROM ALCOHOLS EXXON CHEMICAL PATENTS INC (US) 1995-06-07 EP disclosed
EP-0556297-A1 PROCESS FOR PRODUCING IMINES AND/OR AMINES FROM ALCOHOLS. EXXON CHEMICAL PATENTS INC (US) 1993-08-25 EP disclosed
WO-1992007817-A1 PROCESS FOR PRODUCING IMINES AND/OR AMINES FROM ALCOHOLS EXXON CHEMICAL PATENTS INC. (US) 1992-05-14 WO disclosed
US-5103058-A Catalytic dehydrogenation to aldehyde; refluxing with primary aliphatic amine EXXON CHEMICAL PATENTS INC (US) 1992-04-07 US disclosed
US-4602108-A NITRILOTRIS/METHANEPHOSPHONIC ACID/AND SALTS ETHYL CORPORATION (US) 1986-07-22 US disclosed
US-4098705-A ADDITIVE FOR LUBRICANTS ASAHI DENKA KOGYO K.K. (JP) 1978-07-04 US disclosed