SCHEMBL8439147

SCHEMBL8439147

Cc1nc(C)c(C(=O)O)c(-c2cccc(Cl)c2Cl)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 4/20 0.48
FABP4 P15090 4/20 0.48
KMT2A Q03164 1/20 0.47
TSHR P16473 1/20 0.43
PTPN11 Q06124 9/20 0.42
PRNP P04156 1/20 0.42
PPARG P37231 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
DHODH Q02127 2/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL18680220 0.93 KMT2A (0.47) FABP3FABP4KMT2ATSHRPTPN11
SCHEMBL30587182 0.91 SMN1; SMN2 (0.49) FABP3FABP4KMT2ATSHRPTPN11
SCHEMBL6951228 0.91 SMN1; SMN2 (0.49) FABP3FABP4KMT2ATSHRPTPN11
SCHEMBL28402122 0.85 LMNA (0.50) FABP3FABP4KMT2AKDM4ENPC1
SCHEMBL7979540 0.79 KMT2A (0.39) FABP3FABP4KMT2APTPN11DHODH
SCHEMBL6509414 0.79 LMNA (0.58) FABP3FABP4KMT2ATSHRKDM4E
SCHEMBL28402121 0.78 LMNA (0.51) KMT2AKDM4ENPC1ALDH1A1LMNA
SCHEMBL13410042 0.77 GAA (0.47) KMT2ATSHRPTPN11KDM4ENPC1
SCHEMBL31231118 0.77 GAA (0.56) KMT2ATSHRKDM4ENPC1ALDH1A1
SCHEMBL6949718 0.77 GAA (0.56) KMT2ATSHRKDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662321-B1 Method for producing osmosis-controlled tablets avoiding the use of chlorinated hydrocarbons EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1999-10-20 EP disclosed
EP-0662321-A1 Method for producing osmosis-controlled tablets avoiding the use of chlorinated hydrocarbons EGIS GYOGYSZERGYAR RT. (HU) 1995-07-12 EP disclosed