SCHEMBL9817023

SCHEMBL9817023

Cc1ccc(C(c2ccc(O)c(-c3ccccc3)c2)c2ccc(O)c(-c3ccccc3)c2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.42
TP53 P04637 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
PIM1 P11309 2/20 0.38
ESR2 Q92731 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
BCL2L1 Q07817 1/20 0.37
LMNA P02545 3/20 0.37
CHRM1 P11229 2/20 0.37
ADRA1A P35348 2/20 0.37
TRPA1 O75762 1/20 0.37
SLC6A2 P23975 1/20 0.37

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
SCHEMBL22316987 0.87 TDP1 (0.42) TP53TDP1CYP1A2CYP2C19ALDH1A1
SCHEMBL9817075 0.87 BACE1 (0.46) BACE1HSD17B1HSD17B2ESR2ALDH1A1
SCHEMBL24639580 0.83 BACE1 (0.48) BACE1TP53HSD17B1HSD17B2PIM1
SCHEMBL9817018 0.80 BACE1 (0.42) BACE1HSD17B1HSD17B2ESR2ALDH1A1
SCHEMBL1595103 0.78 BACE1 (0.58) BACE1HSD17B1HSD17B2ESR2ALDH1A1
SCHEMBL31027246 0.78 BACE1 (0.62) BACE1TP53TDP1HSD17B1HSD17B2
SCHEMBL4280343 0.78 BACE1 (0.62) BACE1TP53TDP1HSD17B1HSD17B2
SCHEMBL28225303 0.77 KMT2A (0.46) TP53TDP1CYP1A2CYP2C19ALDH1A1
SCHEMBL6225152 0.76 CACNA2D1 (0.41) TP53TDP1ALDH1A1LMNAMAPT
SCHEMBL7916586 0.76 BACE1 (0.56) BACE1HSD17B1HSD17B2ESR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277627-B1 POLYFORMAL RESINS AND PROCESS FOR PRODUCING SAID RESINS IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-10-23 EP disclosed
US-4801679-A Polyformal resin and process for producing said resin IDEMITSU KOSAN CO., LTD. (JP) 1989-01-31 US disclosed
EP-0277627-A1 Polyformal resins and process for producing said resins IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-08-10 EP disclosed