SCHEMBL23917680

SCHEMBL23917680

CCc1ccc2c(c1)c(CC)cn2C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
PTPN5 P54829 1/20 0.49
PGR P06401 1/20 0.43
RORA P35398 1/20 0.43
RORC P51449 1/20 0.43
RORB Q92753 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
ADRB2 P07550 1/20 0.43
HTR1D P28221 1/20 0.43
HTR6 P50406 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
NQO2 P16083 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
SPR P35270 1/20 0.39
TP53 P04637 1/20 0.39
KDM4E B2RXH2 2/20 0.39

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
SCHEMBL18509197 0.85 LMNA (0.46) MAPTLMNAGAAPTPN5PGR
SCHEMBL10653941 0.81 CDK2 (0.44) MAPTLMNAGAAPTPN5PGR
SCHEMBL821152 0.81 MEN1 (0.40) MAPTLMNAGAAPTPN5PGR
SCHEMBL18015812 0.80 KCNH2 (0.57) GPR84ADRB2HTR1DKMT2AMEN1
SCHEMBL18508879 0.80 KDM4E (0.58) LMNAGPR84ADRB2HTR1DHTR6
SCHEMBL9400590 0.80 ADRB2 (0.49) MAPTLMNAGAAPTPN5GPR84
SCHEMBL12109755 0.80 MAPT (0.40) MAPTLMNAGAAPTPN5PGR
SCHEMBL15167403 0.78 KMT2A (0.58) MAPTLMNAGAAPTPN5KMT2A
SCHEMBL24182195 0.78 RXRA (0.43) MAPTLMNAGAAPTPN5KMT2A
SCHEMBL13888101 0.77 ADRB2 (0.70) ADRB2HTR6NQO2MTNR1AMTNR1B

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
EP-3892305-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY Sutro Biopharma, Inc. (US) 2021-10-13 EP disclosed