SCHEMBL9852681

SCHEMBL9852681

CCCCCCCCCC(CCCCCCCC)NCC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 2/20 0.42
EPHX1 P07099 1/20 0.42
OPRM1 P35372 1/20 0.40
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40
ADH4 P08319 1/20 0.40
ADH7 P40394 1/20 0.40
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
SPHK1 Q9NYA1 1/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL2338635 1.00 LMNA (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL2328457 1.00 LMNA (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL2332772 1.00 LMNA (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL6900932 1.00 LMNA (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL5511019 1.00 LMNA (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL24870689 0.97 DNM1 (0.46) LMNATSHRTHRBDNM1EPHX1
Hydrochloric Acid SCHEMBL29246546 0.97 LMNA (0.41) LMNATSHRTHRBDNM1EPHX1
SCHEMBL16649197 0.97 OPRM1 (0.42) LMNATSHRTHRBDNM1EPHX1
SCHEMBL22602 0.95 LMNA (0.39) LMNATSHRTHRBDNM1EPHX1
Hydrochloric Acid SCHEMBL28410950 0.93 LMNA (0.38) LMNATSHRTHRBDNM1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0421327-A1 Heavy duty laundry detergent ALBEMARLE CORPORATION (US) 1991-04-10 EP disclosed