SCHEMBL11556538

SCHEMBL11556538

CCOc1ccc(OC)c(-c2nc3ccc(C(=O)O)cc3c(=O)[nH]2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ GUSB P08236 3/20 0.46
▸ TP53 P04637 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ESR1 P03372 1/20 0.44
▸ PDE4A P27815 2/20 0.43
▸ PDE4B Q07343 2/20 0.43
▸ PDE4C Q08493 2/20 0.43
▸ PDE4D Q08499 2/20 0.43
▸ CHEK2 O96017 2/20 0.43

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
SCHEMBL11552873 0.92 PDE5A (0.44) KMT2AGUSBTP53POLBMAPT
SCHEMBL11554058 0.92 GUSB (0.51) TSHRKDM4EHSD17B10GUSBTP53
SCHEMBL11550702 0.91 GUSB (0.42) TSHRKDM4EHSD17B10SMN1; SMN2MEN1
SCHEMBL11375670 0.91 GUSB (0.56) TSHRKDM4EHSD17B10SMN1; SMN2GUSB
SCHEMBL11550692 0.88 LMNA (0.43) KDM4ESMN1; SMN2GUSBTP53POLB
SCHEMBL11552844 0.88 GUSB (0.49) KDM4EHSD17B10KMT2AGUSBTP53
SCHEMBL11552075 0.87 GUSB (0.47) KDM4EHSD17B10MEN1KMT2AGUSB
SCHEMBL11549969 0.86 GUSB (0.49) KDM4EHSD17B10GUSBTP53POLB
SCHEMBL11556064 0.86 GUSB (0.49) TSHRKDM4EHSD17B10MEN1KMT2A
SCHEMBL11550603 0.85 GUSB (0.47) TSHRKDM4EHSD17B10SMN1; SMN2GUSB

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-4159330-A ANTIALLERGENS CARLO ERBA S.P.A. (IT) 1979-06-26 — — US claimed
US-4159330-A ANTIALLERGENS CARLO ERBA S.P.A. (IT) 1979-06-26 — — US disclosed
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