SCHEMBL7670463

SCHEMBL7670463

O=c1c(Cc2ccccc2)cn2c3c(cc(OCCCO)cc13)Sc1ccc(Br)cc1-2

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
PLA2G4A P47712 2/20 0.31
USP28 Q96RU2 1/20 0.30
USP25 Q9UHP3 1/20 0.30
UPP1 Q16831 1/20 0.30

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
SCHEMBL7670903 0.90 FPR1 (0.32)
SCHEMBL7666967 0.89
SCHEMBL7666688 0.86 P2RX7 (0.35) ALDH1A1
SCHEMBL7673385 0.86 LTA4H (0.42)
SCHEMBL7672380 0.83 NR1I2 (0.31)
SCHEMBL7674409 0.83 PLA2G7 (0.32)
SCHEMBL7668248 0.83 IDH1 (0.32) ALDH1A1PLA2G4A
SCHEMBL7674978 0.83 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7669032 0.81 LRRK2 (0.35) ALDH1A1
SCHEMBL7674317 0.81 PTK2 (0.36) ALDH1A1

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-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed