SCHEMBL20152035

SCHEMBL20152035

CCNC(=O)c1cc(OCc2ccccc2)no1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.64
BRD4 O60885 5/20 0.48
GABRA5 P31644 2/20 0.47
NMT1 P30419 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 2/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
ADORA1 P30542 1/20 0.43

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
SCHEMBL15004563 0.86 SMPD1 (0.67) SMPD1BRD4GABRA5SMN1; SMN2
SCHEMBL18896166 0.84 SMPD1 (0.64) SMPD1BRD4GABRA5SMN1; SMN2
SCHEMBL630644 0.82 SMPD1 (0.61) SMPD1GABRA5SMN1; SMN2NPC1RAB9A
SCHEMBL10521252 0.82 SMPD1 (0.60) SMPD1BRD4GABRA5SMN1; SMN2ADORA3
SCHEMBL630848 0.82 SMPD1 (0.63) SMPD1NPC1RAB9A
SCHEMBL10519525 0.79 SMPD1 (0.60) SMPD1GABRA5NPC1RAB9A
SCHEMBL23430651 0.79 POLB (0.50) SMPD1POLBNPC1RAB9A
SCHEMBL28789794 0.78 SMPD1 (1.00) SMPD1
SCHEMBL10157720 0.78 SMPD1 (0.59) SMPD1GABRA5NPC1RAB9A
SCHEMBL12909761 0.77 SMPD1 (0.57) SMPD1GABRA5POLBNPC1RAB9A

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
US-20210161869-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
US-10369140-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-08-06 US disclosed
US-20180133198-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-17 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 (3 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-20180133198-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 SMPD1 320/4885BRD4 1381/4885GABRA5 1316/4885
US-10369140-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors DGAT2, MGAT2, MGAT1 SMPD1 320/4885BRD4 1381/4885GABRA5 1316/4885
US-20210161869-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 SMPD1 320/4885BRD4 1381/4885GABRA5 1316/4885

“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.