SCHEMBL8992941

SCHEMBL8992941

Cc1cccc(Cc2ccc(CO)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.49
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
TAAR1 Q96RJ0 2/20 0.47
SLC5A2 P31639 2/20 0.47
IDO1 P14902 2/20 0.46
TSHR P16473 1/20 0.44
DAO P14920 1/20 0.44
IDH1 O75874 1/20 0.42
ACHE P22303 1/20 0.42
CTBP2 P56545 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL8093804 0.89 TAAR1 (0.56) LTA4HSAE1UBA2TAAR1SLC5A2
SCHEMBL8085716 0.85 CALM1 (0.55) LTA4HSAE1UBA2TAAR1IDO1
SCHEMBL11087087 0.85 LTA4H (0.53) LTA4HSAE1UBA2TAAR1SLC5A2
SCHEMBL10735 0.85
SCHEMBL29459538 0.85 TAAR1 (0.60) LTA4HTAAR1SLC5A2IDO1DAO
SCHEMBL30000562 0.85 TAAR1 (0.60) LTA4HTAAR1SLC5A2IDO1DAO
SCHEMBL1263547 0.85 TAAR1 (0.60) LTA4HTAAR1SLC5A2IDO1DAO
SCHEMBL9413536 0.85 TAAR1 (0.48) LTA4HSAE1UBA2TAAR1SLC5A2
SCHEMBL6288838 0.84 ESR1 (0.56) LTA4HSAE1UBA2TAAR1SLC5A2
SCHEMBL27299642 0.84 SLC5A2 (0.49) LTA4HSAE1UBA2SLC5A2TSHR

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-5516777-A PROSTATE CANCER THERAPY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-05-14 US disclosed
US-5409928-A Prostate diseases, alopecia OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-04-25 US disclosed
US-4556409-A CONTROLLING SOYBEAN GROWTH EMERY INDUSTRIES INC. (US) 1985-12-03 US disclosed
US-4522749-A Process for augmenting or enhancing the aroma of a fragrance by adding a vinylcyclopropane compound NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1985-06-11 US disclosed
US-4418202-A HERBICIDES, PESTICIDES EMERY INDUSTRIES, INC. (US) 1983-11-29 US disclosed
US-4380656-A PESTICIDES, HERBICIDES EMERY INDUSTRIES, INC. (US) 1983-04-19 US disclosed