SCHEMBL24851945

SCHEMBL24851945

O=c1[nH]c2ccccc2cc1Cc1ccc(C2CNC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ IL4I1 Q96RQ9 6/20 0.56
▸ ALDH1A1 P00352 8/20 0.44
▸ KDM4E B2RXH2 8/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TSHR P16473 2/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HSD17B10 Q99714 3/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL24852549 0.90 IL4I1 (0.52) IL4I1ALDH1A1KDM4ETSHRCYP3A4
SCHEMBL24852748 0.90 IL4I1 (0.52) IL4I1ALDH1A1KDM4ETSHRCYP3A4
SCHEMBL24852548 0.90 IL4I1 (0.52) IL4I1ALDH1A1KDM4ETSHRCYP3A4
SCHEMBL24852066 0.85 IL4I1 (0.56) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL24852168 0.82 IL4I1 (0.54) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL24852579 0.82 IL4I1 (0.51) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL30162602 0.78 IL4I1 (0.54) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL24852634 0.78 IL4I1 (0.54) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL24851784 0.78 IL4I1 (0.60) IL4I1ALDH1A1KDM4EHPGDTSHR
SCHEMBL30162864 0.76 IL4I1 (0.50) IL4I1ALDH1A1KDM4EHPGDTSHR

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-20240287022-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-08-29 — — US disclosed
WO-2023278222-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-01-05 — — 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-20240287022-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL1RN IL4I1 1/4885ALDH1A1 648/4885KDM4E 878/4885

“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.

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