SCHEMBL38658784

SCHEMBL38658784

CC1NC(=O)Cc2cc(F)ccc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
SRD5A1 P18405 4/20 0.38
KMT2A Q03164 1/20 0.37
HTR2C P28335 2/20 0.37
HTR2A P28223 1/20 0.37
TDP2 O95551 1/20 0.36
CHRNB2 P17787 2/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
CHRNA4 P43681 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CHRNA7 P36544 1/20 0.36
PARP1 P09874 1/20 0.35
ALOX5 P09917 1/20 0.35
IDO1 P14902 2/20 0.35

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
SCHEMBL15919023 0.81 CRHBP (0.40) ACHECRHBPCRHR2SRD5A1KMT2A
SCHEMBL2532588 0.75 SMN1; SMN2 (0.54) HTR2CHTR2ATDP2
SCHEMBL7821415 0.75 SMN1; SMN2 (0.54) HTR2CHTR2ATDP2
SCHEMBL10859456 0.74 SMN1; SMN2 (0.47) CRHBPCRHR2SRD5A1KMT2ATDP2
SCHEMBL20526162 0.72 HTR2C (0.41) ACHESRD5A1HTR2CHTR2ACHRNB2
SCHEMBL18878150 0.70 ACHE (0.42) ACHEHTR2CCA1CA2PARP1
SCHEMBL18863238 0.70 ACHE (0.42) ACHEHTR2CCA1CA2PARP1
SCHEMBL18878104 0.70 ACHE (0.42) ACHEHTR2CCA1CA2PARP1
SCHEMBL10625325 0.70 CYP3A4 (0.46) KMT2ATDP2CHRNB2CHRNA4
SCHEMBL7418174 0.70 TDP2 (0.39) ACHESRD5A1KMT2AHTR2CHTR2A

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
CN-122055343-A Deuterium and aryl amine compounds and uses thereof 泽农医药公司 2026-05-15 CN disclosed