SCHEMBL29560650

SCHEMBL29560650

O=C(c1ccc(F)cc1)c1ccccn1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.72
▸ HSD17B14 Q9BPX1 1/20 0.64
▸ MEN1 O00255 2/20 0.60
▸ RAB9A P51151 3/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ AGTR1 P30556 1/20 0.57
▸ CES1 P23141 2/20 0.53
▸ CES2 O00748 1/20 0.53
▸ LTA4H P09960 1/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ PTGS2 P35354 1/20 0.53
▸ LMNA P02545 1/20 0.52
▸ NAPRT Q6XQN6 1/20 0.52
▸ P4HTM Q9NXG6 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ SNCA P37840 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ GAA P10253 1/20 0.48

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
SCHEMBL17842342 1.00 KMT2A (0.72) KMT2AHSD17B14MEN1RAB9ANPC1
Methane SCHEMBL27540707 0.98 KMT2A (0.70) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL398165 0.84 KMT2A (1.00) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL29373829 0.84 KMT2A (1.00) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL13600090 0.83 KMT2A (0.81) KMT2AHSD17B14RAB9ANPC1CES1
SCHEMBL29571462 0.83 KMT2A (0.75) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL2485773 0.83 KMT2A (0.75) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL20412777 0.82 KMT2A (0.54) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL28015961 0.82 KMT2A (0.96) KMT2AHSD17B14MEN1RAB9ANPC1
SCHEMBL28005707 0.82 KMT2A (0.96) KMT2AHSD17B14MEN1RAB9ANPC1

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-20220296581-A1 Immunomodulation by IAP Inhibitors NOVARTIS AG (CH) 2022-09-22 — — US disclosed
US-11382905-B2 Immunomodulation by IAP inhibitors NOVARTIS AG (CH) 2022-07-12 — — US disclosed
EP-3983401-A1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME Arkuda Therapeutics (US) 2022-04-20 — — EP 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-20220296581-A1 Immunomodulation by IAP Inhibitors BIRC2, BIRC3, BIRC5 KMT2A 3118/4885HSD17B14 4818/4885MEN1 949/4885
US-11382905-B2 Immunomodulation by IAP inhibitors BIRC2, BIRC3, BIRC5 KMT2A 3118/4885HSD17B14 4818/4885MEN1 949/4885

“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.

Send feedback