SCHEMBL10587120

SCHEMBL10587120

C=CCCC(=O)N(CC=C)CC=C

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.71
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.37
ABCC4 O15439 1/20 0.37
RAB9A P51151 1/20 0.33
LMNA P02545 5/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
CCR6 P51684 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
DPP4 P27487 1/20 0.32
HTT P42858 1/20 0.31
FAAH O00519 2/20 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
SCHEMBL11018203 0.88 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL11018205 0.88 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL16350574 0.87 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL12073359 0.87 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL22322158 0.86 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL8068413 0.83 ALDH1A1 (0.91) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL17141436 0.83 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL13630658 0.81 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL7629952 0.81 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2POLBMAPTABCC4
SCHEMBL15049827 0.81 ALDH1A1 (0.86) ALDH1A1SMN1; SMN2POLBMAPTABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4626429-A Conditioning of hair with amides of trialkylacetic acids COLGATE-PALMOLIVE COMPANY (US) 1986-12-02 US claimed
EP-0299634-A2 Silicone polymer termination DOW CORNING CORPORATION (US) 1989-01-18 EP disclosed
US-4626429-A Conditioning of hair with amides of trialkylacetic acids COLGATE-PALMOLIVE COMPANY (US) 1986-12-02 US disclosed
US-4626429-A Conditioning of hair with amides of trialkylacetic acids COLGATE-PALMOLIVE COMPANY (US) 1986-12-02 US disclosed