SCHEMBL19919968

SCHEMBL19919968

CC(C)(C)c1ccc(Sc2ccc(Sc3ccc(-c4ccc(SC(C)(C)c5ccc(O)c(C(=O)O)c5)cc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C2 P52895 1/20 0.46
▸ AKR1C1 Q04828 1/20 0.46
▸ MCL1 Q07820 6/20 0.44
▸ PTPN5 P54829 1/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ACMSD Q8TDX5 3/20 0.42
▸ DHFR P00374 1/20 0.42
▸ HNF4A P41235 1/20 0.42
▸ TDP1 Q9NUW8 2/20 0.40
▸ APP P05067 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ BLM P54132 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
SCHEMBL19919902 0.92 MCL1 (0.51) AKR1C2AKR1C1MCL1PTPN5MEN1
SCHEMBL134234 0.76 HSP90AA1 (0.60) AKR1C2AKR1C1MCL1PTPN5MEN1
SCHEMBL427276 0.74 HSP90AA1 (0.58) AKR1C2AKR1C1MCL1PTPN5MEN1
Hydrochloric Acid SCHEMBL10933935 0.74 HSP90AA1 (0.58) AKR1C2AKR1C1MCL1PTPN5MEN1
SCHEMBL432204 0.74 HSP90AA1 (0.58) AKR1C2AKR1C1MCL1PTPN5MEN1
SCHEMBL7087682 0.74 HSP90AA1 (0.58) AKR1C2AKR1C1MCL1PTPN5MEN1
SCHEMBL19914068 0.73 MCL1 (0.71) AKR1C2AKR1C1MCL1MEN1KMT2A
SCHEMBL19920080 0.72 RXRA (0.58) RXRARXRBRXRG
SCHEMBL9769784 0.71 ACMSD (0.63) MCL1PTPN5MEN1KMT2AKDM4E
SCHEMBL9755159 0.70 CSNK2A1 (0.57) MCL1PTPN5MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10947346-B2 Polyarylene sulfide resin, method for producing same, poly(arylene sulfonium salt), and method for producing poly(arylene sulfonium salt) DIC CORPORATION (JP) 2021-03-16 — — US disclosed
US-20200157284-A1 POLYARYLENE SULFIDE RESIN, METHOD FOR PRODUCING SAME, POLY(ARYLENE SULFONIUM SALT), AND METHOD FOR PRODUCING POLY(ARYLENE SULFONIUM SALT) DAINIPPON INK & CHEMICALS (JP) 2020-05-21 — — US disclosed
US-10577464-B2 Polyarylene sulfide resin, method for producing same, poly(arylene sulfonium salt), and method for producing poly(arylene sulfonium salt) DIC CORPORATION (JP) 2020-03-03 — — US disclosed
US-20180057635-A1 POLYARYLENE SULFIDE RESIN, METHOD FOR PRODUCING SAME, POLY(ARYLENE SULFONIUM SALT), AND METHOD FOR PRODUCING POLY(ARYLENE SULFONIUM SALT) DIC CORPORATION (JP) 2018-03-01 — — US disclosed
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