SCHEMBL28890853

SCHEMBL28890853

C=C(CCCC)C(=O)NCC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.47
CES1 P23141 6/20 0.42
CES2 O00748 5/20 0.42
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
CA1 P00915 1/20 0.38
CASP2 P42575 1/20 0.36
PLA2G2A P14555 2/20 0.36
EPHX1 P07099 2/20 0.35
KMT2A Q03164 1/20 0.35
AKR1B1 P15121 1/20 0.34

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
SCHEMBL720662 0.92 FAAH (0.59) FAAHCES1CES2ALDH1A1PLA2G2A
SCHEMBL2811298 0.91 FAAH (0.40) FAAHALDH1A1CASP2PLA2G2AKMT2A
SCHEMBL20379712 0.86 FAAH (0.40) FAAHCES1CES2ALDH1A1CASP2
SCHEMBL29226167 0.85 PLA2G2A (0.43) FAAHCES1CES2ALDH1A1TP53
SCHEMBL5693537 0.83 CYP1A2 (0.39) FAAHALDH1A1KMT2A
SCHEMBL11238049 0.83 FAAH (0.35) FAAHPLA2G2AKMT2A
SCHEMBL8089101 0.80 HSP90AA1 (0.45) CES1CES2ALDH1A1TP53CA1
SCHEMBL325418 0.80 CES1 (0.44) CES1CES2ALDH1A1TP53CA1
SCHEMBL27839076 0.80 KMT2A (0.37) FAAHKMT2A
SCHEMBL3279306 0.79 CES1 (0.39) FAAHCES1CES2ALDH1A1TP53

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
WO-2022235555-A1 BLOCK COPOLYMERS DERIVED FROM SHORT AND LONG ALKYL CHAIN ACRYLATES OR ACRYLAMIDES AND APPLICATIONS THEREOF ISP INVESTMENTS LLC (US) 2022-11-10 WO disclosed
WO-2022115787-A1 BLOCK COPOLYMERS DERVIED FROM SHORT AND LONG ALKYL CHAIN ACRYLATES OR ACRYLAMIDES AND APPLICATIONS THEREOF ISP INVESTMENTS LLC (US) 2022-06-02 WO disclosed
CN-111826022-A UV (ultraviolet) photocuring high-corrosion-resistance and high-sensitivity liquid photosensitive ink and preparation method thereof 张家港科思创感光新材料有限公司 2020-10-27 CN disclosed
CN-105935344-B Star macromolecules for personal and home care 派诺聚合物技术公司 2020-06-09 CN disclosed