SCHEMBL23978357

SCHEMBL23978357

CCCCc1c(C)nn(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TTR P02766 1/20 0.40
TP53 P04637 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 1/20 0.36
POLB P06746 2/20 0.36
SIRT1 Q96EB6 1/20 0.36
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
ALOX15 P16050 1/20 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
SCHEMBL15694040 0.92 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2TTRTP53CA12
SCHEMBL12844283 0.89 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL30433 0.84 MAPT (0.39) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL6760580 0.79 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2TP53LMNAHTT
SCHEMBL23400598 0.79 HPGD (0.38) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL1780791 0.78 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL12650452 0.75 TTR (0.41) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL22459222 0.75 NR2F2 (0.50) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL16373534 0.75 KDM4E (0.43) ALDH1A1SMN1; SMN2TTRTP53LMNA
SCHEMBL2462506 0.75 CA12 (0.37) ALDH1A1CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 WO disclosed
CN-103571402-B Water-dispersible type acrylic pressure-sensitive adhesive compositions, bonding sheet and optical component are peeled off again 日东电工株式会社 2017-08-25 CN disclosed
CN-103571356-B Adhesive sheet 日东电工株式会社 2017-04-12 CN disclosed
CN-102245616-B Method for producing organolithium compound and method for producing substituted aromatic compound NIPPON SODA CO.,LTD. (JP) 2016-03-30 CN disclosed
CN-102245616-A Method for producing organolithium compound and method for producing substituted aromatic compound NIPPON SODA CO 2011-11-16 CN disclosed