SCHEMBL25475280

SCHEMBL25475280

O=C(CCS)OC1(c2ccccc2)CCNCC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.45
DRD3 P35462 1/20 0.41
OPRD1 P41143 3/20 0.40
OPRK1 P41145 3/20 0.40
TACR1 P25103 2/20 0.38
ACE P12821 1/20 0.38
HTR2A P28223 1/20 0.36
HDAC1 Q13547 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
SCHEMBL25475293 0.92 HTR2A (0.41) OPRM1DRD3OPRD1OPRK1TACR1
SCHEMBL25475398 0.88 OPRM1 (0.47) OPRM1DRD3OPRD1OPRK1TACR1
SCHEMBL26413968 0.87 OPRM1 (0.46) OPRM1DRD3OPRD1OPRK1TACR1
SCHEMBL26413963 0.87 OPRM1 (0.46) OPRM1DRD3OPRD1OPRK1TACR1
SCHEMBL25475283 0.86 DRD2 (0.44) DRD3
SCHEMBL25475290 0.86 DRD2 (0.45) DRD3
SCHEMBL25475281 0.86 OPRM1 (0.37) OPRM1DRD3
SCHEMBL25475291 0.86 MME (0.38) OPRM1DRD3
SCHEMBL24944253 0.86 OPRM1 (0.45) OPRM1DRD3OPRD1OPRK1TACR1
SCHEMBL24944255 0.86 OPRM1 (0.45) OPRM1DRD3OPRD1OPRK1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230161255-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-20230161255-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-20230161252-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-20230161252-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed