SCHEMBL7952267

SCHEMBL7952267

CCC(C)CCOCCO

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL15274090 0.98 MEN1 (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL31602063 0.98 MEN1 (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL31601995 0.98 MEN1 (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL11913261 0.87 TSHR (0.56) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL23665304 0.87 ALDH1A1 (0.39) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL7518724 0.87 HSD17B10 (0.36) TSHRHSD17B10
SCHEMBL13977490 0.87 MEN1 (0.39) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL5930516 0.83 TSHR (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL7953449 0.83
SCHEMBL13346947 0.83 MEN1 (0.55) TSHRMAPK1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102549499-B Dry film photoresist KOLON INC 2013-09-11 CN disclosed
CN-102549499-A Dry film photoresist KOLON INC 2012-07-04 CN disclosed
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
EP-0637298-B1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AG (DE) 1999-03-31 EP disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed
US-5602074-A HERBICIDES; PLANT DESICCATION, DEFOLIATION BASF AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
EP-0641321-A1 SUBSTITUTED ISOINDOLONES BASF Aktiengesellschaft (DE) 1995-03-08 EP disclosed
EP-0637298-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF Aktiengesellschaft (DE) 1995-02-08 EP disclosed
WO-1993024456-A1 SUBSTITUTED ISOINDOLONES BASF AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
WO-1993022280-A1 SUBSTITUTED CYCLOHEXENE-1,2-BICARBOXYLIC ACID DERIVATIVES AND RAW MATERIALS FOR PRODUCING THEM BASF AKTIENGESELLSCHAFT (DE) 1993-11-11 WO disclosed