SCHEMBL8206250

SCHEMBL8206250

NC(=O)COc1cccc2c(CCC(=O)NC(c3ccccc3)c3ccccc3)cccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
TSHR P16473 1/20 0.46
PARP1 P09874 1/20 0.43
KDM4E B2RXH2 3/20 0.41
HTT P42858 2/20 0.41
OGG1 O15527 1/20 0.41
LMNA P02545 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MDM4 O15151 1/20 0.40
MDM2 Q00987 1/20 0.40
POLB P06746 1/20 0.40
USP2 O75604 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 2/20 0.39
GALR3 O60755 1/20 0.39
NR2F2 P24468 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL693383 0.91 TDP1 (0.49) MAPTTDP1TSHRKDM4EMEN1
SCHEMBL8202181 0.88 TSHR (0.48) MAPTTDP1TSHRKDM4EHTT
SCHEMBL8204141 0.87 HTR1B (0.43) MAPTTDP1TSHRKDM4EMEN1
SCHEMBL8201828 0.85 MAPT (0.43) MAPTTDP1TSHRKDM4EMEN1
SCHEMBL8206771 0.85 MAPT (0.42) MAPTTDP1TSHRHTTOGG1
SCHEMBL8201916 0.84 KMT2A (0.52) MAPTTDP1TSHRLMNAMEN1
SCHEMBL8202046 0.83 MAPT (0.42) MAPTTDP1TSHRKDM4EMEN1
SCHEMBL8202557 0.83 SLC6A9 (0.48) MAPTTDP1KDM4EHTTLMNA
SCHEMBL8202190 0.83 MAPK1 (0.43) MAPTTDP1TSHRKDM4EMEN1
SCHEMBL8206298 0.81 ADRB3 (0.46) MAPTTDP1TSHRKDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6013673-A ADMINISTERING AN EFFECTIVE AMOUNT OF A NAPHTHYLOXYACETIC ACID DERIVATIVE OR NONTOXIC ACID ADDITION SALT OR HYDRATE TO TREAT OR PREVENT ABORTION, PAINE, DIARRHEA, CATHARTICS, ULCER, GASTRITIS, HYPERTENSION AND THROMBOSIS ONO PHARMACEUTICAL CO., LTD. (JP) 2000-01-11 US claimed
EP-0719760-B1 Naphthalene derivatives and their use as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO (JP) 1999-09-22 EP claimed
EP-0719760-A1 Naphthyloxyacetic acid derivatives and their use as PGW2 agonists and antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP claimed
US-6013673-A ADMINISTERING AN EFFECTIVE AMOUNT OF A NAPHTHYLOXYACETIC ACID DERIVATIVE OR NONTOXIC ACID ADDITION SALT OR HYDRATE TO TREAT OR PREVENT ABORTION, PAINE, DIARRHEA, CATHARTICS, ULCER, GASTRITIS, HYPERTENSION AND THROMBOSIS ONO PHARMACEUTICAL CO., LTD. (JP) 2000-01-11 US disclosed
EP-0719760-B1 Naphthalene derivatives and their use as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO (JP) 1999-09-22 EP disclosed
EP-0719760-A1 Naphthyloxyacetic acid derivatives and their use as PGW2 agonists and antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed