SCHEMBL29809339

SCHEMBL29809339

CC1CCC(NCc2ccccc2)CC1NCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 1/20 0.55
GRIN2B Q13224 4/20 0.50
KDM1A O60341 3/20 0.50
MEN1 O00255 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 4/20 0.46
BACE1 P56817 4/20 0.46
BCHE P06276 3/20 0.46
OPRM1 P35372 2/20 0.46
OPRL1 P41146 2/20 0.46
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
FYN P06241 1/20 0.43
FABP6 P51161 1/20 0.42

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
SCHEMBL18828620 0.84 FUCA1 (0.72) FUCA1GRIN2BKDM1AMAOA
SCHEMBL25069529 0.84 FUCA1 (0.72) FUCA1GRIN2BKDM1AMAOA
SCHEMBL25176271 0.81 TSHR (0.58) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL3208730 0.79 KMT2A (0.52) FUCA1KDM1AKMT2AFYN
SCHEMBL24511684 0.79 FUCA1 (0.54) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL24511683 0.79 FUCA1 (0.54) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL24511682 0.79 FUCA1 (0.54) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL24511693 0.79 FUCA1 (0.54) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL24511691 0.79 FUCA1 (0.54) FUCA1GRIN2BKDM1AMEN1RAB9A
SCHEMBL22351875 0.79 FUCA1 (0.50) FUCA1GRIN2BKDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4305085-A1 POLYUREA COPOLYMER BASF SE (DE) 2024-01-17 EP claimed
CN-116964122-A Polyurea copolymers 巴斯夫欧洲公司 2023-10-27 CN claimed
WO-2022189242-A1 POLYUREA COPOLYMER BASF SE (DE) 2022-09-15 WO claimed
CN-114846043-A Polyurea copolymers 巴斯夫欧洲公司 2022-08-02 CN claimed
CN-119894954-A System and method for enclosing a PFAS 巴斯夫欧洲公司 2025-04-25 CN disclosed
WO-2024064691-A1 SYSTEM AND METHOD FOR PFAS CONTAINMENT BASF SE (DE) 2024-03-28 WO disclosed
EP-4305085-A1 POLYUREA COPOLYMER BASF SE (DE) 2024-01-17 EP disclosed
CN-116964122-A Polyurea copolymers 巴斯夫欧洲公司 2023-10-27 CN disclosed
EP-4077438-A1 POLYUREA COPOLYMER BASF SE (DE) 2022-10-26 EP disclosed
WO-2022189242-A1 POLYUREA COPOLYMER BASF SE (DE) 2022-09-15 WO disclosed
CN-114846043-A Polyurea copolymers 巴斯夫欧洲公司 2022-08-02 CN disclosed