SCHEMBL23366501

SCHEMBL23366501

CCCOCCOCCOCCOc1ccc2c(c1)N(C(C)C)C(C1CCCCC(C3N(C(C)C)c4ccc(OCCOCCOCCOCCC)cc4N3C(C)C)C1C1N(C(C)C)c3ccc(OCCOCCOCCOCCC)cc3N1C(C)C)N2C(C)C

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.35
▸ HTT P42858 2/20 0.35
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.31
▸ CASR P41180 1/20 0.31
▸ ACACB O00763 7/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ HTR1D P28221 2/20 0.30
▸ HTR1B P28222 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL23009752 0.75 LTA4H (0.41) SIGMAR1HTR1DHTR1BLMNA
SCHEMBL16525691 0.72 CASR (0.38) MAPTCASRACACB
SCHEMBL23366503 0.71 KDM4E (0.39) KDM4EHTTMAPTTAAR1ACACB
SCHEMBL24613003 0.70 CYP1A2 (0.38) KDM4ECYP1A2CYP2D6CYP2C19HRH3
SCHEMBL24613006 0.68 ACACB (0.34) KDM4ECYP1A2CYP2D6CYP2C19CASR
SCHEMBL17916651 0.66 NR5A1 (0.43) HTR1DHTR1BTP53
SCHEMBL19968145 0.63 HRH3 (0.55) CYP1A2CYP2D6CYP2C19MAPTHRH3
SCHEMBL16519550 0.61 BRPF1 (0.51) KDM4EMAPTTAAR1TP53SMN1; SMN2
SCHEMBL26720292 0.61 GPR88 (0.35) —
SCHEMBL17281786 0.59 KDM4E (0.43) KDM4EHTTMAPTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3821982-A1 SUBSTRATE FOR NUCLEIC ACID AMPLIFICATION, AND METHOD FOR MANUFACTURING SAME Korea Research Institute of Bioscience and Biotechnology (KR) 2021-05-19 — — EP disclosed
EP-3821981-A1 SUBSTRATE FOR NUCLEIC ACID AMPLIFICATION, AND METHOD FOR MANUFACTURING SAME Korea Research Institute of Bioscience and Biotechnology (KR) 2021-05-19 — — EP disclosed
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