SCHEMBL26157228

SCHEMBL26157228

CC(=O)C1CC=C(c2cnc(N3CCC(C)CC3)nc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ RIPK1 Q13546 3/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ USP2 O75604 2/20 0.33
▸ AOC3 Q16853 3/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CKS1B P61024 1/20 0.32
▸ SKP1 P63208 1/20 0.32
▸ SKP2 Q13309 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ LMNA P02545 1/20 0.31

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
SCHEMBL26157092 0.83 ALDH1A1 (0.37) KDM4EKMT2AALDH1A1TSHRHPGD
SCHEMBL26157227 0.80 ALDH1A1 (0.33) KMT2AALDH1A1TSHRHPGDPKM
SCHEMBL26157240 0.79 LMNA (0.36) ALDH1A1TSHRLMNA
SCHEMBL25109036 0.76 FGFR1 (0.31) —
SCHEMBL25109488 0.76 FGFR1 (0.31) —
SCHEMBL26157094 0.74 ACACB (0.43) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL24461253 0.74 ACACB (0.43) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL12525598 0.71 NPC1 (0.45) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL26157319 0.71 ADRA1A (0.52) KDM4ECYP2C19KMT2AALDH1A1TSHR
SCHEMBL20152894 0.68 KDM4E (0.50) KDM4ECYP2C19RIPK1KMT2AALDH1A1

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
WO-2023093728-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 江苏先声药业有限公司 2023-06-01 — — WO disclosed
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