SCHEMBL9815797

SCHEMBL9815797

CC(C1CCC(CO)CC1)C(C)C1CCC(CO)CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.35
ESR1 P03372 6/20 0.34
ESR2 Q92731 6/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
SHBG P04278 1/20 0.31
CYP2D6 P10635 1/20 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
SCHEMBL760536 0.84 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL158458 0.84 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL2294170 0.84 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL225662 0.84 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL10814697 0.80 ROCK2 (0.33) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL18413295 0.80 ROCK2 (0.33) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL1461246 0.80 ESR1 (0.32) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL4917793 0.78 SHBG (0.37) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL17219538 0.78 ESR1 (0.31) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL13448499 0.78 ESR1 (0.31) APLNRESR1ESR2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0197458-B1 CURABLE EPOXY RESIN COMPOSITION ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1991-11-06 EP disclosed
US-4689390-A AMINE-EPOXY ADDUCT REACTED WITH PHENOLIC RESIN, ONE-PACK ASAHI DENKA KOGYO K.K. (JP) 1987-08-25 US disclosed
US-4657947-A COVERING RUSTY METAL SURFACES ASAHI DENKA KOGYO K.K. (JP) 1987-04-14 US disclosed
US-4657953-A CORROSION RESISTANCE ASAHI DENKA KOGYO K.K. (JP) 1987-04-14 US disclosed
EP-0197458-A2 Curable epoxy resin composition ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1986-10-15 EP disclosed
US-4535103-A POLYEPOXIDES AND EPOXY RESINS CROSSLINKED AND HARDENED WITH PHOSPHOROUS COMPOUNDS, AMINES, AND DIISOCYANATES ASAHI DENKA KOGYO K.K. (JP) 1985-08-13 US disclosed
US-4530947-A A RUSTY METAL-ADHERING CURABLE MIXTURE OF EPOXIDE-POLYHYDROXIDE REACTION PRODUCT, POLYISOCYANATE AND BITUMINOUS MATERIAL ASAHI DENKA KOGYO K.K. (JP) 1985-07-23 US disclosed
US-4340716-A EPOXY RESINS AND HARDENERS ASAHI DENKA KOGYO K.K. (JP) 1982-07-20 US disclosed
US-3950451-A COUPLED PRODUCT OF ALKYLPHENOL AND PHENOL-FORMALDEHYDE-DIAMINE CONDENSATE ASAHI DENKA KOGYO K.K. (JA) 1976-04-13 US disclosed