SCHEMBL9011829

SCHEMBL9011829

CCCCCC1OC1CCC1OC1CCC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
SPHK1 Q9NYA1 7/20 0.38
SPHK2 Q9NRA0 6/20 0.38
EPHX1 P07099 1/20 0.38
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
POLB P06746 1/20 0.33
FASN P49327 1/20 0.33
DAGLA Q9Y4D2 1/20 0.33
CYP1A2 P05177 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
SCHEMBL51551 0.97 ALDH1A1 (0.42) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL51731 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL9806410 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL13513577 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL9806406 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL9928622 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL9806415 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL11435680 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL2397638 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR
SCHEMBL6087782 0.95 ALDH1A1 (0.46) ALDH1A1SPHK1SPHK2EPHX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0169674-B2 Polymer powders ALLIED COLLOIDS LTD (GB) 1996-11-20 EP disclosed
EP-0169674-B1 POLYMER POWDERS Ciba Specialty Chemicals Water Treatments Limited (GB) 1990-05-09 EP disclosed
US-4778836-A WATER SOLUBLE ANIONIC OR CATIONIC ACRYLIC POLYMERS AS ANTIAGGLOMERANTS ALLIED COLLOIDS LIMITED (GB) 1988-10-18 US disclosed
EP-0169674-A2 Polymer powders Ciba Specialty Chemicals Water Treatments Limited (GB) 1986-01-29 EP disclosed