SCHEMBL11550692

SCHEMBL11550692

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

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ GUSB P08236 2/20 0.43
▸ MAPT P10636 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ PDE4A P27815 2/20 0.41
▸ PDE4B Q07343 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ CHEK2 O96017 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ MGLL Q99685 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 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
SCHEMBL11550603 0.92 GUSB (0.47) LMNASMN1; SMN2NPSR1GUSBMAPT
SCHEMBL11551327 0.90 ALDH1A1 (0.49) LMNASMN1; SMN2NPSR1GUSBMAPT
SCHEMBL11556538 0.88 TSHR (0.47) SMN1; SMN2GUSBMAPTTP53POLB
SCHEMBL11375670 0.87 GUSB (0.56) LMNASMN1; SMN2NPSR1GUSBMAPT
SCHEMBL11552873 0.87 PDE5A (0.44) LMNAGUSBMAPTTP53POLB
SCHEMBL11553482 0.86 BRD4 (0.40) LMNASMN1; SMN2NPSR1GUSBMAPT
SCHEMBL11550702 0.84 GUSB (0.42) SMN1; SMN2GUSBMAPTTP53POLB
SCHEMBL11556986 0.84 KMT2A (0.44) LMNASMN1; SMN2NPSR1MAPTPOLB
SCHEMBL11552075 0.83 GUSB (0.47) LMNAGUSBMAPTTP53POLB
SCHEMBL11554058 0.82 GUSB (0.51) LMNAGUSBMAPTTP53POLB

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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