SCHEMBL883797

SCHEMBL883797

CCNC(=O)c1ccc(F)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
HPGD P15428 3/20 0.56
POLB P06746 2/20 0.54
THRB P10828 1/20 0.54
RECQL P46063 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
PYGL P06737 8/20 0.51
CTSL P07711 1/20 0.50
SLC6A9 P48067 1/20 0.48
LMNA P02545 1/20 0.48
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL23430714 0.87 HSD17B10 (0.49) NPC1RAB9AHPGDPOLBTHRB
SCHEMBL4148502 0.83 POLB (0.76) NPC1HPGDPOLBTHRBRECQL
SCHEMBL6068233 0.83 CES2 (0.55) NPC1RAB9AL3MBTL1LMNAKDM4E
SCHEMBL22231347 0.83 ALDH1A1 (0.56) NPC1RAB9AHPGDPOLBTHRB
SCHEMBL12121109 0.81 HPGD (0.68) NPC1RAB9AHPGDPOLBTHRB
SCHEMBL25376547 0.81 SLC6A9 (0.46) NPC1RAB9AL3MBTL1SLC6A9LMNA
SCHEMBL3147754 0.81 KDM4E (0.68) NPC1RAB9AHPGDPYGLCTSL
SCHEMBL883798 0.81 HPGD (0.61) NPC1RAB9AHPGDPYGLCTSL
SCHEMBL12462051 0.81 HPGD (0.57) NPC1RAB9AHPGDPOLBTHRB
SCHEMBL6356258 0.81 PYGL (0.66) NPC1RAB9AHPGDPOLBL3MBTL1

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-20210161869-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
WO-2012038081-A1 SUBSTITUTED BENZAMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-03-29 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-20210161869-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 NPC1 97/4885RAB9A 1973/4885HPGD 951/4885

“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.