SCHEMBL5649749

SCHEMBL5649749

O=C(On1cc(Sc2ccccc2)cn1)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
FKBP1A P62942 1/20 0.44
KMT2A Q03164 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
EPHX1 P07099 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
TSHR P16473 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
SCHEMBL5646918 0.88 SMN1; SMN2 (0.41) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL5649601 0.81 ALDH1A1 (0.44) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL5650940 0.75 TP53 (0.42) TP53KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL5649795 0.75 RAB9A (0.43) TP53SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL5646470 0.75 TSHR (0.43) TP53KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL5646943 0.73 HPGD (0.45) TP53FKBP1AKMT2ASMN1; SMN2MEN1
SCHEMBL27564848 0.71 SMN1; SMN2 (0.47) TP53KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL16975545 0.71 AKR1C3 (0.44) SMN1; SMN2RAB9AKDM4EALDH1A1LMNA
SCHEMBL5646920 0.70 RAB9A (0.40) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL27564847 0.70 TP53 (0.38) TP53KMT2ASMN1; SMN2MEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030166644-A1 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK A/S (DK) 2003-09-04 US claimed
US-7279470-B2 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK A/S (DK) 2007-10-09 US disclosed
US-7067517-B2 Use of compounds for decreasing activity of hormone-sensitive lipase NERO NORDISK A/S (DK) 2006-06-27 US disclosed
US-20030166644-A1 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK A/S (DK) 2003-09-04 US disclosed
US-20030166690-A1 Use of compounds for decreasing activity of hormone-sensitive NOVO NORDISK A/S (DK) 2003-09-04 US 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 (2 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-20030166644-A1 Compounds and uses thereof for decreasing activity of hormone-sensitive lipase LIPE, PNLIP, LPL TP53 3399/4885FKBP1A 2663/4885KMT2A 4150/4885
US-20030166690-A1 Use of compounds for decreasing activity of hormone-sensitive LIPE, PNLIP, LPL TP53 3352/4885FKBP1A 2072/4885KMT2A 4322/4885

“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.