SCHEMBL25575178

SCHEMBL25575178

Cc1c(C)c(C)c(-c2cc(-c3c(C)c(C)c(C)c(C)c3C)cc(-c3c(C)c(C)c(O)c(C)c3C)c2)c(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP1 Q9P0U3 1/20 0.42
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ SELL P14151 1/20 0.33
▸ SELP P16109 1/20 0.33
▸ SELE P16581 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ NQO1 P15559 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ TBXA2R P21731 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ LDHA P00338 1/20 0.30
▸ LDHB P07195 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL18855324 0.80 SENP1 (0.37) SENP1CA1CA2
SCHEMBL25574478 0.76 ERN1 (0.31) SENP1
SCHEMBL28193538 0.75 SENP1 (0.46) SENP1KDM4EMEN1MAPTKMT2A
SCHEMBL2527849 0.75 SENP1 (0.41) SENP1CA1CA2SELLSELP
SCHEMBL397768 0.74 ALOX5 (0.36) SENP1CA1CA2SELLSELP
SCHEMBL29820017 0.74 HSD17B1 (0.48) SENP1CA2ACHECYP3A4CYP1A2
SCHEMBL8375599 0.74 SENP1 (0.50) SENP1KDM4EMEN1MAPTKMT2A
SCHEMBL573213 0.74 SENP1 (0.77) SENP1CA1CA2ACHECYP3A4
SCHEMBL17753399 0.72 CA1 (0.59) SENP1CA1CA2ACHECYP3A4
SCHEMBL992964 0.72 SENP1 (0.39) SENP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159710-A1 Two-Dimensional Coordination Polymer Based On Isocyano Coordination SHANGHAI JIAO TONG UNIVERSITY (CN) 2023-05-25 — — US disclosed
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