SCHEMBL5157465

SCHEMBL5157465

CC(C(=O)O)C1OCCO1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
GABRA1 P14867 3/20 0.33
GABRA5 P31644 3/20 0.33
GABRB2 P47870 3/20 0.33
GABRR1 P24046 2/20 0.33
GABRA4 P48169 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ACE P12821 1/20 0.31

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
SCHEMBL5132165 0.76 TP53 (0.32) TP53
SCHEMBL9425465 0.72
SCHEMBL4220900 0.72
SCHEMBL9425473 0.72
SCHEMBL27337370 0.70 SHBG (0.32) ALDH1A1
SCHEMBL7284524 0.70 SMN1; SMN2 (0.33) TP53TSHRALDH1A1
SCHEMBL7284518 0.70 SMN1; SMN2 (0.33) TP53TSHRALDH1A1
SCHEMBL9359834 0.70 CPA1 (0.34)
SCHEMBL2482831 0.69 RAB9A (0.43) ALDH1A1
SCHEMBL2482835 0.69 RAB9A (0.43) ALDH1A1

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
CN-116324530-A Integrated multilayer optical film 3M创新有限公司 2023-06-23 CN disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
CN-105189473-A Ketal adducts, methods of manufacture, and uses thereof SEGETIS INC 2015-12-23 CN disclosed
EP-1742929-A1 TRISUBSTITUTED FURANS SUITABLE FOR THE PREPARATION OF FRAGRANCE COMPOSITIONS Givaudan SA (CH) 2007-01-17 EP disclosed
WO-2005087756-A1 TRISUBSTITUTED FURANS SUITABLE FOR THE PREPARATION OF FRAGRANCE COMPOSITIONS GIVAUDAN SA (CH) 2005-09-22 WO disclosed
US-4344939-A ANTIBIOTICS, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed