SCHEMBL27670693

SCHEMBL27670693

CCCCCC(CC)(CC)NCCCC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
ALDH1A1 P00352 1/20 0.36
EPHX1 P07099 3/20 0.33
THRB P10828 1/20 0.32
FDPS P14324 10/20 0.31
GGPS1 O95749 7/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH7 P40394 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL9206621 0.98 EPHX1 (0.37) TSHRALDH1A1EPHX1THRBFDPS
SCHEMBL9213836 0.93 EPHX1 (0.42) TSHRALDH1A1EPHX1THRBFDPS
SCHEMBL9206460 0.93 EPHX1 (0.42) TSHRALDH1A1EPHX1THRBFDPS
Hydrochloric Acid SCHEMBL11863080 0.91 EPHX1 (0.41) TSHRALDH1A1EPHX1THRBADH1B
SCHEMBL9204362 0.88 EPHX1 (0.37) TSHRALDH1A1EPHX1THRBFDPS
SCHEMBL16975497 0.88 TSHR (0.36) TSHRALDH1A1ADH1BADH1CADH1A
SCHEMBL31375083 0.88 TSHR (0.36) TSHRALDH1A1ADH1BADH1CADH1A
SCHEMBL28012333 0.85 TSHR (0.41) TSHRALDH1A1EPHX1THRBADH1B
SCHEMBL474330 0.85 SMN1; SMN2 (0.39) TSHRALDH1A1FDPSGGPS1
Bromide SCHEMBL6036066 0.82 TSHR (0.46) TSHRALDH1A1EPHX1FDPSADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1997910-B Method for determining the integrated sun protection factor comprising UVA and UVB radiation COTY BV 2012-03-21 CN claimed
CN-1997910-A Method for determining the integrated sun protection factor comprising UVA and UVB radiation COTY BV (NL) 2007-07-11 CN claimed
CN-103796627-B Comprise the cosmetic composition of the water-in-oil emulsion form of jasmonic acid derivative OU LAIYA (FR) 2016-03-30 CN disclosed
CN-1997910-B Method for determining the integrated sun protection factor comprising UVA and UVB radiation COTY BV 2012-03-21 CN disclosed
CN-1997910-A Method for determining the integrated sun protection factor comprising UVA and UVB radiation COTY BV (NL) 2007-07-11 CN disclosed