SCHEMBL9149495

SCHEMBL9149495

CCC(C)CCC(=O)Oc1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ESR1 P03372 2/20 0.45
HIF1A Q16665 2/20 0.45
ELANE P08246 3/20 0.44
BCL9 O00512 1/20 0.42
CTNNB1 P35222 1/20 0.42
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FFAR1 O14842 1/20 0.38

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
SCHEMBL9149502 1.00 KMT2A (0.47) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL668103 0.85 ELANE (0.45) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL9724817 0.83 ELANE (0.61) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL9724815 0.83 ELANE (0.61) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL9144630 0.82 L3MBTL1 (0.52) LMNAFFAR1
SCHEMBL9144634 0.82 L3MBTL1 (0.52) LMNAFFAR1
SCHEMBL17138199 0.81 ELANE (0.48) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL27770626 0.80 ALOX15 (0.40) HTTELANE
SCHEMBL27941251 0.80 KMT2A (0.48) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL10358648 0.79 ELANE (0.57) KMT2AALDH1A1MAPTLMNAHTT

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-5399701-A Polyfluoroalkyloxypyridinecarboxylic acid and -carboxaldehyde intermediates MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-03-21 US disclosed
EP-0255236-B1 Fluorine-containing chiral smectic liquid crystals MINNESOTA MINING & MFG (US) 1994-05-04 EP disclosed
US-5254747-A Fluorine-containing chiral smectic liquid crystals MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-10-19 US disclosed
US-4886619-A TILTED OR LATENT TILTED MESOPHASES; BLENDS; FERROELECTRIC DEVICE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-12-12 US disclosed
EP-0255236-A2 Fluorine-containing chiral smectic liquid crystals MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-02-03 EP disclosed