SCHEMBL6766655

SCHEMBL6766655

O=C(NC1CCC(O)CC1)c1[c]cccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.47
MFN2 O95140 1/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BRD4 O60885 4/20 0.42
HSD11B1 P28845 1/20 0.41
SMYD3 Q9H7B4 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
BRD2 P25440 2/20 0.39
BRD3 Q15059 2/20 0.39
BRDT Q58F21 2/20 0.39
HPGD P15428 2/20 0.39
P2RX7 Q99572 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
GLA P06280 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
SCHEMBL1990596 0.94 NPC1 (0.49) EPHX2NPC1RAB9AMEN1KMT2A
SCHEMBL1115073 0.87 NPC1 (0.47) EPHX2NPC1RAB9AMEN1KMT2A
SCHEMBL4778685 0.87 NPC1 (0.51) EPHX2NPC1RAB9AMEN1KMT2A
SCHEMBL14911305 0.86 NPC1 (0.54) EPHX2NPC1RAB9AMEN1KMT2A
SCHEMBL28160616 0.77 KDM1A (0.39) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4694494 0.75 NPC1 (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3833694 0.72 HSD17B10 (0.46) EPHX2RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL224092 0.70 HDAC8 (0.46) MEN1KMT2ASMN1; SMN2KDM4ELMNA
SCHEMBL13162370 0.70 NPC1 (0.74) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2771766 0.70 CRBN (0.51) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase ABBOTT LABORATORIES 2004-03-11 US disclosed
WO-2003076408-A2 INDAZOLE DERIVATIVES THAT ARE ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE ABBOTT LABORATORIES (US) 2003-09-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase GUCY1B1, GUCY1A1, GUCY1A2 EPHX2 2682/4885MFN2 4477/4885NPC1 1740/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.