SCHEMBL10620486

SCHEMBL10620486

CC/C(=C\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.71
MAPT P10636 7/20 0.71
CYP3A4 P08684 6/20 0.71
RXRA P19793 5/20 0.71
RARA P10276 4/20 0.71
RARB P10826 4/20 0.71
RARG P13631 4/20 0.71
PTGS1 P23219 4/20 0.71
APP P05067 4/20 0.71
SNCA P37840 4/20 0.71
MAPK1 P28482 3/20 0.71
ALOX15 P16050 3/20 0.71
ADORA3 P0DMS8 3/20 0.71
RXRB P28702 2/20 0.71
RXRG P48443 2/20 0.71
RORC P51449 2/20 0.71
HTR2B P41595 2/20 0.71
BLM P54132 2/20 0.71
HIF1A Q16665 2/20 0.71
DRD3 P35462 2/20 0.71

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
SCHEMBL10618596 1.00 ALDH1A1 (0.71) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10620490 0.91 ALDH1A1 (0.69) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10620498 0.91 ALDH1A1 (0.69) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10618595 0.88 ALDH1A1 (0.66) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10618589 0.88 ALDH1A1 (0.66) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10619239 0.86 ALDH1A1 (0.78) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL10619245 0.86 ALDH1A1 (0.78) ALDH1A1MAPTCYP3A4RXRARARA
SCHEMBL11480262 0.86 ALDH1A1 (0.78) ALDH1A1MAPTCYP3A4RXRARARA
Beta Carotene SCHEMBL4092791 0.86 ALDH1A1 (0.89) ALDH1A1MAPTCYP3A4RXRARARA
Retinal SCHEMBL6064696 0.85 ALDH1A1 (0.84) ALDH1A1MAPTCYP3A4RXRARARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0100433-B1 ALPHA-ALKYL POLYOLEFINIC CARBOXYLIC ACIDS AND DERIVATIVES THEREOF USEFUL IN THE TREATMENT OF PSORIASIS RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-03-23 EP claimed
US-4505930-A Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis and allergic responses USV PHARMACEUTICAL CORPORATION (US) 1985-03-19 US claimed
US-4472430-A Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis USV PHARMACEUTICAL CORPORATION (US) 1984-09-18 US claimed
EP-0100433-A2 Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis RORER INTERNATIONAL (OVERSEAS) INC. (US) 1984-02-15 EP claimed
EP-0100433-B1 ALPHA-ALKYL POLYOLEFINIC CARBOXYLIC ACIDS AND DERIVATIVES THEREOF USEFUL IN THE TREATMENT OF PSORIASIS RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-03-23 EP disclosed
US-4694023-A Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis and allergic responses USV PHARMACEUTICAL CORPORATION (US) 1987-09-15 US disclosed
US-4534979-A Polyene compounds useful in the treatment of psoriasis and allergic responses USV PHARMACEUTICAL CORP. (US) 1985-08-13 US disclosed
US-4505930-A Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis and allergic responses USV PHARMACEUTICAL CORPORATION (US) 1985-03-19 US disclosed
US-4472430-A Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis USV PHARMACEUTICAL CORPORATION (US) 1984-09-18 US disclosed
EP-0100433-A2 Alpha-alkyl polyolefinic carboxylic acids and derivatives thereof useful in the treatment of psoriasis RORER INTERNATIONAL (OVERSEAS) INC. (US) 1984-02-15 EP disclosed