SCHEMBL8793906

SCHEMBL8793906

CCCC(=O)C1C(=O)CC(C)(C)C(C(=O)OC)C1=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 3/20 0.48
GAA P10253 2/20 0.48
ALOX12 P18054 1/20 0.48
ALDH1A1 P00352 8/20 0.46
LMNA P02545 1/20 0.46
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
POLB P06746 1/20 0.42
THRB P10828 1/20 0.41

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
SCHEMBL15457519 0.85 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL8793705 0.84 GAA (0.51) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL10917680 0.82 GAA (0.45) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL26985257 0.81 SMN1; SMN2 (0.57) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL1901074 0.78 ALDH1A1 (0.47) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL1901070 0.78 ALDH1A1 (0.47) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL19295462 0.73 SMN1; SMN2 (0.65) SMN1; SMN2MEN1KMT2ATSHRGAA
SCHEMBL9751480 0.72 GAA (0.38) SMN1; SMN2TSHRGAAALOX12ALDH1A1
SCHEMBL9396153 0.72 ALDH1A1 (0.76) MEN1KMT2ATSHRGAAALDH1A1
SCHEMBL9751435 0.70 GAA (0.37) TSHRGAAALOX12ALDH1A1LMNA

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
US-5696050-A APPLYING TO CROP PLANT, SEED OR SURROUNDING SOIL OR WATER ANTIDOTAL AMOUNT OF PLANT SAFENING AGENT AMERICAN CYANAMID COMPANY (US) 1997-12-09 US disclosed
EP-0613618-B1 Method for safening herbicides in crops using substituted benzopyran and tetrahydronaphthalene compounds AMERICAN CYANAMID CO (US) 1997-04-16 EP disclosed
US-5516918-A PLANT SAFTENING AGENTS USING BENZOPYRAN-4-ACETIC ACIDS OR BENZOTHIOPYRAN-4-ACETIC ACIDS AMERICAN CYANAMID COMPANY (US) 1996-05-14 US disclosed
US-5407897-A Plant safening agents AMERICAN CYANAMID COMPANY (US) 1995-04-18 US disclosed
EP-0613618-A1 Method for safening herbicides in crops using substituted benzopyran and tetrahydronaphthalene compounds AMERICAN CYANAMID COMPANY (US) 1994-09-07 EP disclosed