SCHEMBL11765853

SCHEMBL11765853

CCC(O)CNCCCCCCNCC(O)CC

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM1A O60341 1/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2A Q12879 2/20 0.34
KMT2A Q03164 1/20 0.34
S1PR2 O95136 5/20 0.33
S1PR4 O95977 5/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
S1PR5 Q9H228 1/20 0.33
ADRB2 P07550 1/20 0.33

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
SCHEMBL11765569 0.97 PKM (0.50) PKMANPEPERAP2KDM4EALDH1A1
SCHEMBL27726084 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL27705506 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL27705519 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL27705619 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL24459668 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL7325532 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL6249621 0.93 ANPEP (0.50) PKMANPEPERAP2ALDH1A1TSHR
SCHEMBL27414997 0.92 PKM (0.44) PKMANPEPERAP2KDM4EALDH1A1
SCHEMBL27322284 0.91 EPHX1 (0.44) PKMANPEPERAP2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746194-B2 Method for preparing topological elastomers with highly branched structures, low modulus and high elasticity ZHEJIANG UNIVERSITY (CN) 2023-09-05 US disclosed
US-11746194-B2 Method for preparing topological elastomers with highly branched structures, low modulus and high elasticity ZHEJIANG UNIVERSITY (CN) 2023-09-05 US disclosed
US-20210317273-A1 METHOD FOR PREPARING TOPOLOGICAL ELASTOMERS WITH HIGHLY BRANCHED STRUCTURES, LOW MODULUS AND HIGH ELASTICITY ZHEJIANG UNIVERSITY (CN) 2021-10-14 US disclosed
US-3933699-A OXAZOLIDINE OR ENAMINE BASF WYANDOTTE CORPORATION (US) 1976-01-20 US disclosed