SCHEMBL24878609

SCHEMBL24878609

COc1cccc(N2CCN(C(=O)Cn3nc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)c4c3CCC4)CC2)c1F

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.43
IDO1 P14902 2/20 0.42
RAB9A P51151 1/20 0.42
TP53 P04637 3/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
THRB P10828 1/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL30128924 0.90 ALOX15 (0.48) ALOX15IDO1RAB9ATP53MAPT
SCHEMBL24877805 0.90 ALOX15 (0.48) ALOX15IDO1RAB9ATP53MAPT
SCHEMBL30129310 0.89 ALOX15 (0.51) ALOX15SMN1; SMN2IDO1RAB9ATP53
SCHEMBL24878034 0.89 ALOX15 (0.51) ALOX15SMN1; SMN2IDO1RAB9ATP53
SCHEMBL24877871 0.89 ALOX15 (0.47) ALOX15SMN1; SMN2IDO1TP53ALDH1A1
SCHEMBL24878636 0.87 ALOX15 (0.50) ALOX15SMN1; SMN2IDO1TP53ALDH1A1
SCHEMBL30128999 0.86 IDO1 (0.48) ALOX15IDO1RAB9ATP53KDM4E
SCHEMBL24877825 0.86 IDO1 (0.48) ALOX15IDO1RAB9ATP53KDM4E
SCHEMBL24878639 0.86 ALOX15 (0.45) ALOX15SMN1; SMN2IDO1ALDH1A1MAPT
SCHEMBL30129004 0.86 ALOX15 (0.45) ALOX15SMN1; SMN2IDO1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3886845-B1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2, 3-DIOXYGENASE (IDO) INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-09-04 EP claimed
US-12264134-B2 Substituted piperazine amide compounds as indoleamine 2,3-dioxygenase (IDO) inhibitors MERCK SHARP & DOHME LLC (US) 2025-04-01 US disclosed
US-20230008022-A1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS MERCK SHARP & DOHME CORP. (US) 2023-01-12 US disclosed
US-20230008022-A1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS MERCK SHARP & DOHME CORP. (US) 2023-01-12 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-20230008022-A1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS IDO1, IDO2, KYNU ALOX15 633/4885SMN1; SMN2 3055/4885IDO1 1/4885
US-12264134-B2 Substituted piperazine amide compounds as indoleamine 2,3-dioxygenase (IDO) inhibitors IDO1, IDO2, AADAC ALOX15 859/4885SMN1; SMN2 2974/4885IDO1 1/4885

“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.