SCHEMBL11564152

SCHEMBL11564152

Cc1c(Cl)cccc1Nc1ccccc1C(=O)C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 10/20 0.78
PTGS2 P35354 5/20 0.78
MEN1 O00255 2/20 0.78
LMNA P02545 2/20 0.78
CYP1A2 P05177 2/20 0.78
CYP3A4 P08684 2/20 0.78
CYP2C9 P11712 2/20 0.78
AKR1C3 P42330 2/20 0.78
KMT2A Q03164 2/20 0.78
HIF1A Q16665 2/20 0.78
CYP2C19 P33261 2/20 0.78
USP2 O75604 1/20 0.78
TTR P02766 1/20 0.78
PLA2G1B P04054 1/20 0.78
PGR P06401 1/20 0.78
HTR1A P08908 1/20 0.78
ADRA2A P08913 1/20 0.78
ADORA3 P0DMS8 1/20 0.78
AR P10275 1/20 0.78
MAPT P10636 1/20 0.78

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
Tolfenamic Acid SCHEMBL25190 0.88 MT-CO2 (1.00) MT-CO2PTGS2MEN1LMNACYP1A2
Tolfenamic Acid SCHEMBL29484181 0.88 MT-CO2 (1.00) MT-CO2PTGS2MEN1LMNACYP1A2
Tolfenamic Acid SCHEMBL29389998 0.88 MT-CO2 (1.00) MT-CO2PTGS2MEN1LMNACYP1A2
Tolfenamic Acid SCHEMBL8060884 0.88 MT-CO2 (1.00) MT-CO2PTGS2MEN1LMNACYP1A2
Tolfenamic Acid SCHEMBL27540385 0.86 MT-CO2 (0.97) MT-CO2PTGS2MEN1LMNACYP1A2
SCHEMBL12608896 0.84 MT-CO2 (0.77) MT-CO2PTGS2MEN1LMNACYP1A2
SCHEMBL16579971 0.83 MT-CO2 (0.75) MT-CO2PTGS2MEN1LMNACYP1A2
SCHEMBL29940889 0.83 MT-CO2 (0.75) MT-CO2PTGS2MEN1LMNACYP1A2
SCHEMBL11518282 0.83 PTGS2 (0.56) MT-CO2PTGS2MEN1LMNACYP1A2
Tolfenamic Acid SCHEMBL10619715 0.82 MT-CO2 (0.89) MT-CO2PTGS2MEN1LMNACYP1A2

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
US-4173577-A ANTICOAGULANTS; ANTIINFLAMMATORY AGENTS; ANTIPYRETICS; ANALGESICS CIBA-GEIGY CORPORATION (US) 1979-11-06 US disclosed
US-4092430-A ANTICOAGULANTS, ANALGESTIC, ANTIPYRETIC ACTIVITY CIBA-GEIGY CORPORATION (US) 1978-05-30 US disclosed