SCHEMBL19782956

SCHEMBL19782956

CCNC(=O)CCCCCC(C)C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.64
KDM4C Q9H3R0 2/20 0.46
KDM4A O75164 1/20 0.46
PHF8 Q9UPP1 1/20 0.46
KDM2A Q9Y2K7 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPK1 P28482 1/20 0.46
DEGS1 O15121 1/20 0.44
CETP P11597 1/20 0.44

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
SCHEMBL22917089 1.00 FAAH (0.64) FAAHKDM4CKDM4APHF8KDM2A
SCHEMBL23581448 1.00 FAAH (0.64) FAAHKDM4CKDM4APHF8KDM2A
SCHEMBL18772640 0.98 FAAH (0.61) FAAHKDM4CKDM4APHF8KDM2A
SCHEMBL14552886 0.92 FAAH (0.57) FAAHMEN1KMT2ACYP1A2POLB
SCHEMBL425951 0.86 ALDH1A1 (0.55) FAAHKDM4CKDM4APHF8KDM2A
SCHEMBL2540536 0.86 KDM4C (0.47) FAAHKDM4CKDM4APHF8KDM2A
SCHEMBL10064157 0.85 FAAH (0.86) FAAHMEN1KMT2ATSHRMAPK1
SCHEMBL13268369 0.85 FAAH (0.86) FAAHMEN1KMT2ATSHRMAPK1
SCHEMBL17670549 0.85 FAAH (0.60) FAAHMEN1KMT2AMAPK1CAPN1
SCHEMBL20035023 0.85 CASP2 (0.48) FAAHMEN1KMT2ATSHRCAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023116920-A1 PENTA- FUSED HEXA-HETEROCYCLIC COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE 杭州多域生物技术有限公司 2023-06-29 WO disclosed
EP-3831841-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T Global Inc. (US) 2021-06-09 EP disclosed
WO-2018013525-A1 NUCLEIC ACID CONJUGATES AND USES THEREOF TRANSLATE BIO MA, INC. (US) 2018-01-18 WO disclosed