SCHEMBL7662091

SCHEMBL7662091

CN1c2cc(Br)ccc2-n2cc(Cc3cccnc3)c(=O)c3cc(OCn4nnc5ccccc54)cc1c32

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 4/20 0.34
KCNJ5 P48544 4/20 0.34
KCNJ3 P48549 4/20 0.34
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
PTK2 Q05397 1/20 0.32
RIPK1 Q13546 1/20 0.31
FPR1 P21462 1/20 0.31
FPR2 P25090 1/20 0.31

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
SCHEMBL7666498 0.97 KCNA5 (0.34) KCNA5KCNJ5KCNJ3RAB9AMEN1
SCHEMBL7671531 0.90 FPR1 (0.32) RAB9ACYP1A2CYP3A4CYP2C9PTK2
SCHEMBL7666445 0.89 FPR1 (0.32) RAB9ACYP1A2CYP3A4CYP2C9PTK2
SCHEMBL7669036 0.86 PTK2 (0.34) RAB9ACYP1A2CYP3A4CYP2C9PTK2
SCHEMBL7669107 0.86 PTK2 (0.34) RAB9ACYP1A2CYP3A4CYP2C9PTK2
SCHEMBL7672395 0.86 PTK2 (0.32) KCNA5KCNJ5KCNJ3PTK2
SCHEMBL7668484 0.86 PTK2 (0.33) RAB9APTK2
SCHEMBL7674089 0.86 PTK2 (0.32) PTK2
SCHEMBL7673333 0.86 PTK2 (0.32) PTK2
SCHEMBL7668560 0.85 PTK2 (0.33) RAB9ACYP1A2CYP3A4CYP2C9PTK2

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