SCHEMBL10673700

SCHEMBL10673700

O=C(O)CCCC(=O)c1cc(-c2ccccc2)nc2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.66
▸ LMNA P02545 1/20 0.66
▸ SMN1; SMN2 Q16637 1/20 0.66
▸ PDE10A Q9Y233 1/20 0.66
▸ DHODH Q02127 5/20 0.62
▸ TACR3 P29371 3/20 0.58
▸ CYP3A4 P08684 1/20 0.57
▸ POLB P06746 1/20 0.56
▸ TSHR P16473 1/20 0.54
▸ CYP2C9 P11712 1/20 0.53
▸ AKR1C3 P42330 1/20 0.53
▸ AKR1C2 P52895 1/20 0.53
▸ AKR1C1 Q04828 1/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ GFER P55789 1/20 0.52
▸ KMT2A Q03164 1/20 0.52

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
SCHEMBL10679321 0.93 LMNA (0.68) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL1878543 0.82 KDM4E (0.69) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL10674581 0.81 PDE10A (0.55) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL10673312 0.80 PDE10A (0.54) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL29376617 0.80 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL7588217 0.80 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL25519 0.80 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL10673669 0.79 KDM4E (0.57) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL17923232 0.79 MAPT (0.53) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL4464779 0.79 KDM4E (0.97) KDM4ELMNASMN1; SMN2PDE10ADHODH

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-4788204-A TRANQUILIZERS; ANTICONVULSANTS; ANGINA AND IMMUNODIFICIENCY TREATMENTS RHONE-POULENC SANTE (FR) 1988-11-29 — — US disclosed
US-4788199-A ANXIOLYTICS, ANTICONVULSANTS, ANTIANGINA AGENTS RHONE-POULENC SANTE (FR) 1988-11-29 — — US disclosed
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