SCHEMBL4454996

SCHEMBL4454996

c1ccc(CC(OP(OC(Cc2ccccc2)(c2ccccc2)c2ccccc2)OC(Cc2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
SLC6A2 P23975 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
KIF11 P52732 1/20 0.38
KCNA5 P22460 1/20 0.37
LMNA P02545 1/20 0.36
CYP2D6 P10635 1/20 0.36
TRPA1 O75762 1/20 0.36
HIF1A Q16665 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.35
TSHR P16473 1/20 0.34
FDPS P14324 1/20 0.34
CETP P11597 1/20 0.34
CYP3A4 P08684 2/20 0.33
KCNH2 Q12809 2/20 0.33
RECQL P46063 1/20 0.33
MRGPRX2 Q96LB1 1/20 0.33

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
SCHEMBL4455000 0.84 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL7001871 0.80 CYP1A2 (0.52) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL11248544 0.77 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL11374241 0.77 KCNN4 (0.39) CYP2C19TAAR1KIF11LMNACYP2D6
SCHEMBL11021424 0.77 TSHR (0.37) CYP1A2CYP2C9CYP2C19TAAR1KIF11
SCHEMBL5145585 0.77 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL9614595 0.77 CYP1A2 (0.54) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL238218 0.77 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL765190 0.77 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1
SCHEMBL9494714 0.76 TAAR1 (0.50) CYP1A2CYP2C9CYP2C19SLC6A2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353945-A1 REACTIVE RESINS BASED ON ETHYL METHACRYLATE RÖHM GMBH (DE) 2025-11-20 US disclosed
US-20250179285-A1 TERMINALLY UNSATURATED (METH)ACRYLATE CROSSLINKERS AND USE THEREOF RÖHM GMBH (DE) 2025-06-05 US disclosed
EP-4519336-A1 TERMINALLY UNSATURATED (METH)ACRYLATE CROSSLINKERS AND USE THEREOF Röhm GmbH (DE) 2025-03-12 EP disclosed
CN-115916895-B Curing reaction resins using unsaturated peroxides as initiators and organic phosphites as accelerators 罗姆化学有限责任公司 2024-10-29 CN disclosed
WO-2023237574-A1 REACTION RESIN BASED ON ETHYL METHACRYLATE RÖHM GMBH (DE) 2023-12-14 WO disclosed
WO-2023213708-A1 TERMINALLY UNSATURATED (METH)ACRYLATE CROSSLINKERS AND USE THEREOF RÖHM GMBH (DE) 2023-11-09 WO disclosed
CN-112679543-B Lipophilic fluorescein probe and preparation method thereof 天津全和诚科技有限责任公司 2022-07-22 CN disclosed
EP-3929245-A1 CURING OF REACTIVE RESINS USING UNSATURATED PEROXIDES AS INITIATOR AND ORGANIC PHOSPHITES AS ACCELERATORS Röhm GmbH (DE) 2021-12-29 EP disclosed
CN-112679543-A Lipophilic fluorescein probe and preparation method thereof 天津全和诚科技有限责任公司 2021-04-20 CN disclosed
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed
US-4067903-A Manufacture of arylamines BASF AKTIENGESELLSCHAFT (DT) 1978-01-10 US disclosed