SCHEMBL8375982

SCHEMBL8375982

N=C(N)NCCCC(C(=O)c1nc2ccccc2s1)N1CCC[C@H]1C(=O)NC(=O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.47
PRSS1 P07477 2/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
PRKD3 O94806 1/20 0.39
F10 P00742 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39
PRKCG P05129 1/20 0.39
PRKCB P05771 1/20 0.39
F7 P08709 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCI P41743 1/20 0.39
PRKCE Q02156 1/20 0.39
PRKCQ Q04759 1/20 0.39
PRKCZ Q05513 1/20 0.39
PRKCD Q05655 1/20 0.39
PRKD1 Q15139 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL8939655 1.00 F2 (0.47) F2PRSS1PRSS2PRSS3PRKD3
SCHEMBL2526255 0.91 F2 (0.46) F2PRSS1PRSS2PRSS3PRKD3
SCHEMBL7504596 0.89 F2 (0.45) F2PRSS1PRSS2PRSS3PRKD3
SCHEMBL7434967 0.88 F2 (0.43) F2PRSS1PRSS2PRSS3PRKD3
SCHEMBL7504771 0.86 F2 (0.43) F2PRSS1PRSS2PRSS3PRKD3
SCHEMBL7498504 0.86 F2 (0.46) F2PRSS1PRSS2PRSS3
SCHEMBL6972547 0.86 F2 (0.43) F2
SCHEMBL8939612 0.85 F2 (0.40) F2
SCHEMBL6976859 0.84 F2 (0.39) F2PRSS1PRSS2PRSS3
SCHEMBL7506385 0.84 F2 (0.40) F2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948308-A1 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) 1999-10-13 EP disclosed
WO-1999004752-A9 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER (US) 1999-04-08 WO disclosed
WO-1999004752-A2 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 1999-02-04 WO disclosed