SCHEMBL3818403

SCHEMBL3818403

CCCC(N)(NC(N)=O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
FDPS P14324 1/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4C Q9H3R0 1/20 0.33
GGT1 P19440 1/20 0.31
ARG1 P05089 1/20 0.31
ARG2 P78540 1/20 0.31
NAALAD2 Q9Y3Q0 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
SCHEMBL12006238 0.84 ALDH1A1 (0.33) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL5803387 0.84 ALDH1A1 (0.33) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL11708028 0.84 ALDH1A1 (0.33) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL2886844 0.76 ODC1 (0.40) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL27967649 0.76 CTSK (0.39) ALDH1A1MEN1KMT2ALMNAHSD17B10
SCHEMBL30496170 0.76 ARG1 (0.31) ARG1ARG2
SCHEMBL28844285 0.75 ALDH1A1 (0.39) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL11589563 0.74 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL8709507 0.73 FDPS (0.36) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL11412698 0.73 LMNA (0.39) ALDH1A1CYP1A2FDPSLMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0858794-B1 Hair care products KAO CORP (JP) 2009-08-05 EP disclosed
EP-0673647-B1 Dermatological composition containing lactic acid salt BRISTOL MYERS SQUIBB CO (US) 1999-02-17 EP disclosed
EP-0673648-B1 Compositions comprising amphotoic salts of alpha-hydroxy acids and glycerol monocaprylate BRISTOL MYERS SQUIBB CO (US) 1998-11-25 EP disclosed
EP-0858794-A2 Hair care products KAO CORPORATION (JP) 1998-08-19 EP disclosed
US-5705168-A LACTIC ACID FOR SKIN DISORDERS BRISTOL-MYERS, SQUIBB COMPANY (US) 1998-01-06 US disclosed
US-5702711-A AS INORGANIC OR ORGANIC LACTATE SALT BRISTOL-MYERS SQUIBB COMPANY (US) 1997-12-30 US disclosed
EP-0673647-A1 Dermatological composition containing lactic acid salt Bristol-Myers Squibb Company (US) 1995-09-27 EP disclosed
EP-0673648-A1 Compositions comprising amphotoic salts of alpha-hydroxy acids and glycerol monocaprylate Bristol-Myers Squibb Company (US) 1995-09-27 EP disclosed
US-5420106-A Method and composition having enhanced alpha-hydroxy acid skin permeation and retention BRISTOL-MYERS SQUIBB COMPANY (US) 1995-05-30 US disclosed