SCHEMBL9637110

SCHEMBL9637110

COC(=O)CCC(=O)c1ccccc1C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.53
POLB P06746 2/20 0.53
LMNA P02545 4/20 0.52
TSHR P16473 4/20 0.52
ALDH1A1 P00352 4/20 0.50
CFTR P13569 1/20 0.50
KDM4E B2RXH2 5/20 0.49
KMT2A Q03164 2/20 0.49
ATM Q13315 1/20 0.49
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.47
GLA P06280 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA5A P35218 1/20 0.45
CA9 Q16790 1/20 0.45
ALOX15 P16050 1/20 0.45
CTNNB1 P35222 1/20 0.44
WNT3A P56704 1/20 0.44
GAA P10253 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
SCHEMBL9725361 0.86 LMNA (0.52) HSD17B10POLBLMNATSHRALDH1A1
SCHEMBL22323625 0.84 KDM4E (0.56) HSD17B10POLBLMNATSHRALDH1A1
SCHEMBL9953421 0.84 TSHR (0.53) HSD17B10POLBLMNATSHRALDH1A1
Dimethyl Phthalate SCHEMBL27682943 0.84 HSD17B10 (0.54) HSD17B10POLBLMNATSHRALDH1A1
Dimethyl Phthalate SCHEMBL16949664 0.83 TSHR (0.61) HSD17B10POLBLMNATSHRALDH1A1
SCHEMBL8481048 0.82 LMNA (0.47) HSD17B10POLBLMNATSHRALDH1A1
SCHEMBL11581372 0.82 LMNA (0.56) HSD17B10LMNATSHRALDH1A1KDM4E
SCHEMBL31686110 0.81 CTNNB1 (0.66) LMNAALDH1A1KMT2AHTTGLA
SCHEMBL20945673 0.81 ERCC5 (0.53) HSD17B10POLBLMNATSHRALDH1A1
SCHEMBL30955358 0.81 ERCC5 (0.53) HSD17B10POLBLMNATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5149823-A Sulfonamide substituted spirodilactams SHELL OIL COMPANY (US) 1992-09-22 US disclosed
US-5145910-A Ketocarboxylated polymers SHELL OIL COMPANY (US) 1992-09-08 US disclosed
US-5112938-A CYANO- AND CARBOXY-SUBSTITUTED SPIRODILACTAMS SHELL OIL COMPANY (US) 1992-05-12 US disclosed
US-5093465-A Polyamide containing spirodilactam moieties SHELL OIL COMPANY (US) 1992-03-03 US disclosed
US-5093499-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1992-03-03 US disclosed
US-5061780-A Poly(ether-bis-imide-spiro dilactam) polymer SHELL OIL COMPANY (US) 1991-10-29 US disclosed
US-5037948-A Cyano- and carboxy-substituted spirodilactams SHELL OIL COMPANY (US) 1991-08-06 US disclosed
US-5034504-A Spirodilactam polyamide polymer SHELL OIL COMPANY (US) 1991-07-23 US disclosed
US-5028688-A Polyamideimide polymers SHELL OIL COMPANY (US) 1991-07-02 US disclosed
US-4978736-A Polyamideimide polymers SHELL OIL COMPANY (US) 1990-12-18 US disclosed
US-4968812-A Spirolactonelactams SHELL OIL COMPANY (US) 1990-11-06 US disclosed
US-4968770-A Polyamide from spirodilactam precursor and primary diamine SHELL OIL COMPANY (US) 1990-11-06 US disclosed
US-4940801-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1990-07-10 US disclosed
US-4927906-A Novel polyamideimide polymers SHELL OIL COMPANY (US) 1990-05-22 US disclosed
US-4885351-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1989-12-05 US disclosed