SCHEMBL2175085

SCHEMBL2175085

CC(c1ccc(Br)cc1)C(O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ALOX5 P09917 1/20 0.44
KMT2A Q03164 1/20 0.41
LDHA P00338 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
FPR2 P25090 2/20 0.40
DPP4 P27487 1/20 0.39
POLB P06746 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP7 P09237 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
FPR1 P21462 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CNR1 P21554 1/20 0.38

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
SCHEMBL18492913 0.82 CYP1A2 (0.47) CYP1A2SMN1; SMN2ALOX5KMT2ALDHA
SCHEMBL180160 0.81 LMNA (0.54) LMNAKDM4E
SCHEMBL10024370 0.81 LMNA (0.54) LMNAKDM4E
SCHEMBL7525226 0.81 LMNA (0.54) LMNAKDM4E
SCHEMBL2165511 0.80 KDM4E (0.36) CYP1A2SMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL15703611 0.78 ALOX5 (0.51) CYP1A2SMN1; SMN2ALOX5KMT2ALDHA
SCHEMBL18497904 0.78 FPR2 (0.51) CYP1A2SMN1; SMN2ALOX5KMT2ALDHA
SCHEMBL421564 0.77 PTGS2 (0.61) CYP1A2SMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL5149430 0.77 PTGS2 (0.61) CYP1A2SMN1; SMN2ALOX5ALDH1A1LMNA
SCHEMBL3860971 0.77 PTGS2 (0.61) CYP1A2SMN1; SMN2ALOX5ALDH1A1LMNA

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
US-7973063-B2 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-07-05 US disclosed
EP-1742608-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϝ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-01-17 EP disclosed
WO-2005108352-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE PPARϜ-TYPE RECEPTORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-11-17 WO disclosed