SCHEMBL10906262

SCHEMBL10906262

C=CCCCC(O)/C(C)=C/CC

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
USP2 O75604 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL10906265 1.00 TSHR (0.38) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL7041325 0.86 USP2 (0.33) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL1677747 0.83 TSHR (0.46) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL8229916 0.83 TSHR (0.46) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL8229914 0.83 TSHR (0.46) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL1677744 0.83 TSHR (0.46) TSHRALDH1A1USP2CYP3A4MAPT
SCHEMBL10906796 0.82 ALOX15 (0.35) TSHRALDH1A1
SCHEMBL10906797 0.82 ALOX15 (0.35) TSHRALDH1A1
SCHEMBL10902251 0.79 GPR84 (0.39) TSHRALDH1A1MAPTSMN1; SMN2
SCHEMBL10902255 0.79 GPR84 (0.39) TSHRALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4572795-A UNSATURATED ACYCLIC ALCOHOLS GIVAUDAN CORPORATION (US) 1986-02-25 US claimed
EP-0086945-B1 ALKENOLS, PROCESS FOR THEIR PREPARATION, THEIR USE AS FRAGRANCES AND FLAVOURING COMPOSITIONS CONTAINING THESE ALKENOLS L. GIVAUDAN & CIE Société Anonyme (CH) 1984-12-05 EP claimed
EP-0086945-A1 Alkenols, process for their preparation, their use as fragrances and flavouring compositions containing these alkenols L. GIVAUDAN & CIE Société Anonyme (CH) 1983-08-31 EP claimed
US-4572795-A UNSATURATED ACYCLIC ALCOHOLS GIVAUDAN CORPORATION (US) 1986-02-25 US disclosed
EP-0086945-B1 ALKENOLS, PROCESS FOR THEIR PREPARATION, THEIR USE AS FRAGRANCES AND FLAVOURING COMPOSITIONS CONTAINING THESE ALKENOLS L. GIVAUDAN & CIE Société Anonyme (CH) 1984-12-05 EP disclosed
EP-0086945-A1 Alkenols, process for their preparation, their use as fragrances and flavouring compositions containing these alkenols L. GIVAUDAN & CIE Société Anonyme (CH) 1983-08-31 EP disclosed