SCHEMBL527305

SCHEMBL527305

O[C@H]1CCC2CCCCC2C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.42
ALOX5 P09917 1/20 0.34
SLC18A3 Q16572 3/20 0.33
LMNA P02545 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP3A4 P08684 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
SCHEMBL7377837 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL5708868 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL295551 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL31382808 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL9035146 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL3372644 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
SCHEMBL17951347 1.00 ALDH1A1 (0.47) ALDH1A1TSHRALOX5SLC18A3LMNA
Methane SCHEMBL22471696 0.97 ALDH1A1 (0.44) ALDH1A1TSHRALOX5SLC18A3
Hydrochloric Acid SCHEMBL27683979 0.97 ALDH1A1 (0.44) ALDH1A1TSHRALOX5SLC18A3
SCHEMBL9909854 0.94 ALDH1A1 (0.39) ALDH1A1TSHRALOX5LMNACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3800176-A1 NOVEL POLYMERISABLE MONOMERS AND THEIR USE AS REACTIVE DILUENTS IN CURABLE COMPOSITIONS Align Technology, Inc. (US) 2021-04-07 EP disclosed
US-9517977-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2016-12-13 US disclosed
EP-2598644-A1 ENZYMATIC ACYLATION METHOD USING AN ACYLPHOSPHONATE DONOR PCAS Biosolution (FR) 2013-06-05 EP disclosed
WO-2012013765-A1 ENZYMATIC ACYLATION METHOD USING AN ACYLPHOSPHONATE DONOR PCAS BIOSOLUTION (FR) 2012-02-02 WO disclosed
EP-0927238-A2 RINSE ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1999-07-07 EP disclosed
WO-1998007811-A2 RINSE ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO disclosed