SCHEMBL7939563

SCHEMBL7939563

C[C@H]1CCCC(C)(C)C1CCCO

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 6/20 0.49
NR1H4 Q96RI1 1/20 0.32
CETP P11597 1/20 0.32
PTGES2 Q9H7Z7 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
SCHEMBL7940649 1.00 UGT2B7 (0.49) UGT2B7NR1H4CETPPTGES2
SCHEMBL6846565 0.89 UGT2B7 (0.46) UGT2B7CETP
Propanol SCHEMBL1942397 0.84 UGT2B7 (0.36) UGT2B7CETP
SCHEMBL3661700 0.83 CYP1A2 (0.38) UGT2B7
SCHEMBL23086227 0.81 UGT2B7 (0.35) UGT2B7CETP
SCHEMBL4666688 0.80 UGT2B7 (0.47) UGT2B7CETP
SCHEMBL14142960 0.80 UGT2B7 (0.47) UGT2B7CETP
SCHEMBL14993455 0.80 UGT2B7 (0.47) UGT2B7CETP
SCHEMBL17633428 0.80 EPHX1 (0.36) UGT2B7CETP
SCHEMBL28679355 0.80 UGT2B7 (0.41) UGT2B7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE37159-E1 Propanol derivatives and perfumes containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-05-01 US claimed
EP-0456932-B1 Propanol derivatives and perfumes containing the same TAKASAGO PERFUMERY CO LTD (JP) 1995-01-18 EP claimed
US-5250512-A Diffusible, stable amber-like fragrance with high retention TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-10-05 US claimed
EP-0456932-A1 Propanol derivatives and perfumes containing the same Takasago International Corporation (JP) 1991-11-21 EP claimed
JP-4021642-A None JP disclosed
US-RE37159-E1 Propanol derivatives and perfumes containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-05-01 US disclosed
US-RE37159-E1 Propanol derivatives and perfumes containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-05-01 US disclosed
EP-0456932-B1 Propanol derivatives and perfumes containing the same TAKASAGO PERFUMERY CO LTD (JP) 1995-01-18 EP disclosed
US-5250512-A Diffusible, stable amber-like fragrance with high retention TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-10-05 US disclosed
US-5250512-A Diffusible, stable amber-like fragrance with high retention TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-10-05 US disclosed
JP-H0421642-A NEW PROPANOL DERIVATIVE AND PERFUME CONTAINING THE SAME DERIVATIVE AS ACTIVE INGREDIENT TAKASAGO INTERNATL CORP 1992-01-24 JP disclosed
EP-0456932-A1 Propanol derivatives and perfumes containing the same Takasago International Corporation (JP) 1991-11-21 EP disclosed
EP-0456932-A1 Propanol derivatives and perfumes containing the same Takasago International Corporation (JP) 1991-11-21 EP disclosed