SCHEMBL19990890

SCHEMBL19990890

O=C(O)NCCCOCCOCCOCCCNC(=O)n1ccnc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
ALDH1A1 P00352 3/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.33
NAMPT P43490 1/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.32
CYP19A1 P11511 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL15570675 0.92 SMN1; SMN2 (0.36) L3MBTL1TDP1SMN1; SMN2ALDH1A1LMNA
SCHEMBL17209724 0.88 L3MBTL1 (0.40) L3MBTL1SMN1; SMN2ALDH1A1NPC1GAA
SCHEMBL17112312 0.85 ALDH1A1 (0.39) L3MBTL1SMN1; SMN2ALDH1A1NPC1NAMPT
SCHEMBL28730480 0.84 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2ALDH1A1NPC1GAA
SCHEMBL12031906 0.82 L3MBTL1 (0.33) L3MBTL1TDP1SMN1; SMN2ALDH1A1NPC1
SCHEMBL6094890 0.79 SMN1; SMN2 (0.36) TDP1SMN1; SMN2ALDH1A1NPC1GAA
SCHEMBL17760913 0.77 IDE (0.39) SMN1; SMN2NPC1NAMPTLMNACYP19A1
SCHEMBL19125727 0.77 EPHX1 (0.40) L3MBTL1SMN1; SMN2ALDH1A1GAALMNA
SCHEMBL4256419 0.76 QPCT (0.43) L3MBTL1TDP1SMN1; SMN2GAAHTT
SCHEMBL13519414 0.75 TBXAS1 (0.53) TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11952434-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-09 US disclosed
US-20230101323-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-03-30 US disclosed
US-11358988-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-06-14 US disclosed
EP-3778622-A1 MACROCYCLIC PEPTIDES USEFUL AS IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2021-02-17 EP disclosed
EP-3218392-B1 MACROCYCLIC PEPTIDES USEFUL AS IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2020-07-29 EP disclosed
US-20200216498-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2020-07-09 US disclosed
US-10633419-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-04-28 US disclosed
US-20180086793-A1 IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-29 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 (6 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-11952434-B2 Immunomodulators CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885
US-20230101323-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885
US-10633419-B2 Immunomodulators CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885
US-11358988-B2 Immunomodulators CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885
US-20180086793-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885
US-20200216498-A1 IMMUNOMODULATORS CD74, ICOS, HAVCR2 L3MBTL1 1391/4885TDP1 1967/4885SMN1; SMN2 4268/4885

“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.