SCHEMBL3929448

SCHEMBL3929448

O=C(O)Cc1ccc(O)c(CN2CCNC(=O)C2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ NFKB1 P19838 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ RGS12 O14924 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ THPO P40225 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ GNAI1 P63096 1/20 0.43
▸ PMP22 Q01453 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ CA2 P00918 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ PDCD1 Q15116 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
SCHEMBL3930964 0.86 ALDH1A1 (0.45) TSHRKDM4EPOLBGAAMAPT
SCHEMBL3936709 0.79 CCR5 (0.52) SMN1; SMN2
SCHEMBL3047472 0.72 SMN1; SMN2 (0.47) KDM4EPOLBGAATDP1LMNA
SCHEMBL6707987 0.71 GRM2 (0.47) LMNAHSD17B10CA2GRM2SMN1; SMN2
SCHEMBL10825727 0.70 GAA (0.70) TSHRKDM4EPOLBGAANFKB1
SCHEMBL220097 0.70 SIGMAR1 (0.62) TSHRGAATDP1HIF1AALDH1A1
SCHEMBL4751222 0.68 SMN1; SMN2 (0.58) KDM4EPOLBTDP1LMNABLM
SCHEMBL2988721 0.68 KMT2A (0.51) TSHRKDM4EPOLBGAANFKB1
SCHEMBL12125341 0.67 HPGD (0.66) TSHRKDM4EPOLBGAANFKB1
SCHEMBL166595 0.67 SMN1; SMN2 (0.52) TSHRPOLBHSD17B10ALDH1A1SMN1; SMN2

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-2044044-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2009-04-08 — — EP disclosed
WO-2007143745-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-13 — — WO disclosed
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