SCHEMBL7922235

SCHEMBL7922235

CCCc1n[nH]c(C(=O)NC)c1NC(=O)c1cc(C(=O)OC(C)(C)C)ccc1OCC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
PARP1 P09874 2/20 0.34
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALOX15 P16050 1/20 0.34
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
HDAC8 Q9BY41 3/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33
TERT O14746 1/20 0.33

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
SCHEMBL7450573 0.80 HSD17B10 (0.40) SMN1; SMN2TP53MAPTPARP1HPGD
SCHEMBL7362179 0.73 KMT2A (0.45) SMN1; SMN2MAPTNPSR1L3MBTL1ALOX15
SCHEMBL7451494 0.72 APEX1 (0.47) KDM4EKMT2AHDAC1HDAC6ALDH1A1
SCHEMBL963 0.72 MAPT (0.48) SMN1; SMN2TP53MAPTPARP1RXFP1
SCHEMBL7927917 0.71 ALDH1A1 (0.50) CREBBPSMN1; SMN2TP53MAPTHPGD
SCHEMBL7922226 0.70 LMNA (0.50) CREBBPSMN1; SMN2L3MBTL1KMT2ARAB9A
SCHEMBL7922567 0.69 SMN1; SMN2 (0.42) CREBBPSMN1; SMN2ALOX15HDAC8HDAC1
SCHEMBL7960724 0.64 TERT (0.65) CREBBPSMN1; SMN2MAPTHDAC8HDAC1
SCHEMBL10401303 0.63 TSHR (0.44) CREBBPSMN1; SMN2NPSR1ALDH1A1RAB9A
SCHEMBL5334070 0.61 ALDH1A1 (0.57) CREBBPSMN1; SMN2MAPTHPGDKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1085893-A1 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES Advanced Medicine, Inc. (US) 2001-03-28 EP disclosed
WO-1999064033-A9 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES ADVANCED MEDICINE INC (US) 2000-07-27 WO disclosed
WO-1999064033-A1 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed