SCHEMBL9633965

SCHEMBL9633965

O=CN1CCC(CBr)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL3127073 0.82 CNR2 (0.30)
SCHEMBL10846475 0.79 ALDH1A1 (0.34)
SCHEMBL11009997 0.77 HSD17B10 (0.31) HSD17B10
SCHEMBL14514193 0.76 HSD17B10 (0.31) HSD17B10
SCHEMBL1307333 0.76 HSD17B10 (0.35) TFPI2HSD17B10
SCHEMBL23516990 0.76 CNR2 (0.35) HSD17B10
SCHEMBL17813336 0.76 HSD17B10 (0.31) HSD17B10
SCHEMBL2384801 0.76 NCF1 (0.50) HSD17B10
SCHEMBL10638063 0.76 HSD17B10 (0.31) HSD17B10
SCHEMBL6650415 0.73 CHRM2 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5162523-A CEPHALOSPORIN ANTIBACTERIAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 1992-11-10 US disclosed
US-5159077-A Bactericide, antibiotic HOFFMANN-LA ROCHE INC. (US) 1992-10-27 US disclosed
EP-0409081-A1 Beta-Lactam Derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-01-23 EP disclosed
US-4605744-A ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1986-08-12 US disclosed
US-4537969-A AZOLE-SUBSTITUTED SATURATED HETEROCYCLIC CARBOXALDEHYDE ACETALS;INTERMEDIATES FOR 6-AMIDINOPENICILLINS HOFFMANN-LA ROCHE INC. (US) 1985-08-27 US disclosed
EP-0148283-A1 Novel penicillanic acid derivatives F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1985-07-17 EP disclosed
US-4431653-A ANTIBIOTICS; BACTERICIDES; SSYNERGISTIC WITH AMINO ACID DERIVATIVE HOFFMANN-LA ROCHE INC. (US) 1984-02-14 US disclosed
US-4246262-A ANTIBIOTICS LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1981-01-20 US disclosed