SCHEMBL9330528

SCHEMBL9330528

CCC1CC(=O)NC12NC(=O)CC2CC

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.36
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
MMP13 P45452 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
SCHEMBL16889196 0.78 CRBN (0.33) CRBNBRD4CREBBPKDM4ELMNA
SCHEMBL28316310 0.78 KDM4E (0.34) CRBNBRD4CREBBPKDM4ELMNA
SCHEMBL1169368 0.69 SMN1; SMN2 (0.56) KDM4ELMNATSHR
SCHEMBL26660615 0.65 CRBN (0.33) CRBNBRD4CREBBPKDM4ELMNA
SCHEMBL19438354 0.64 CRBN (0.52) CRBNBRD4CREBBPKDM4ELMNA
SCHEMBL16885266 0.63 CRBN (0.31) CRBN
SCHEMBL21244594 0.63 BRD4 (0.34) CRBNBRD4
SCHEMBL26793110 0.63 CRBN (0.31) CRBN
SCHEMBL28315276 0.62 CRBN (0.39) CRBNBRD4CREBBPKDM4ELMNA
SCHEMBL4559467 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0359340-B1 Spirodilactam polymers SHELL INT RESEARCH (NL) 1994-03-16 EP disclosed
US-5034504-A Spirodilactam polyamide polymer SHELL OIL COMPANY (US) 1991-07-23 US disclosed
US-4968770-A Polyamide from spirodilactam precursor and primary diamine SHELL OIL COMPANY (US) 1990-11-06 US disclosed
EP-0359340-A2 Spirodilactam polymers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-03-21 EP disclosed
US-4908458-A 1,5-Di(benzoheterocyclic)-3-oxopentane derivatives SHELL OIL COMPANY (US) 1990-03-13 US disclosed