SCHEMBL26157116

SCHEMBL26157116

CCCCN1CCC(c2cnc(N3CCC(C)CC3)nc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ DRD5 P21918 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ SIGMAR1 Q99720 4/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAOB P27338 1/20 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
SCHEMBL26157121 0.92 DRD2 (0.51) DRD2LMNAMAPTALDH1A1TSHR
SCHEMBL26157324 0.86 TSHR (0.44) DRD2HRH3ALDH1A1TSHRL3MBTL1
SCHEMBL26157262 0.83 ALDH1A1 (0.42) DRD2HRH3ALDH1A1TSHRL3MBTL1
SCHEMBL24461261 0.81 TSHR (0.41) TP53MAPTALDH1A1TSHRL3MBTL1
SCHEMBL26157117 0.80 DRD2 (0.49) DRD2TP53TSHRHTR1ADRD1
SCHEMBL26157095 0.79 TSHR (0.44) LMNATP53MAPTALDH1A1TSHR
SCHEMBL24461258 0.79 TSHR (0.44) LMNATP53MAPTALDH1A1TSHR
SCHEMBL24461260 0.79 TSHR (0.44) LMNATP53MAPTALDH1A1TSHR
SCHEMBL26157322 0.77 ALDH1A1 (0.39) TP53MAPTALDH1A1TSHRL3MBTL1
SCHEMBL24461815 0.77 TSHR (0.44) LMNATP53MAPTALDH1A1TSHR

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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