SCHEMBL23084380

SCHEMBL23084380

Cn1c(-c2ccccc2)cc2cc(O)c(O)cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.62
▸ CYP19A1 P11511 1/20 0.51
▸ GPR35 Q9HC97 1/20 0.50
▸ ALDH1A1 P00352 5/20 0.47
▸ HPGD P15428 4/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ ADORA2B P29275 1/20 0.43
▸ DAO P14920 1/20 0.42
▸ MAOA P21397 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ SLC2A1 P11166 1/20 0.40
▸ APP P05067 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CCNB2 O95067 1/20 0.40
▸ CDK1 P06493 1/20 0.40
▸ CCNB1 P14635 1/20 0.40

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
SCHEMBL8305794 0.81 KMT2A (0.72) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL20473138 0.81 KMT2A (0.66) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL21244780 0.78 GRIK1 (0.58) KMT2AGPR35ALDH1A1KDM4E
SCHEMBL21244829 0.78 KMT2A (0.41) KMT2ACYP19A1GPR35ALDH1A1HPGD
SCHEMBL29581156 0.77 KMT2A (1.00) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL214075 0.77 KMT2A (1.00) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL12278994 0.76 KMT2A (0.59) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL12278040 0.76 KMT2A (0.59) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL11662919 0.75 KMT2A (0.68) KMT2ACYP19A1ALDH1A1HPGDKDM4E
SCHEMBL11686076 0.75 KMT2A (0.68) KMT2ACYP19A1ALDH1A1HPGDKDM4E

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-20230124268-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME UNIV INDIANA TRUSTEES (US) 2023-04-20 — — US disclosed
US-11584766-B2 Nicotinamide phosphoribosyltransferase inhibitors and methods for use of the same THE TRUSTEES OF INDIANA UNIVERSITY (US) 2023-02-21 — — US disclosed
US-20210070784-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2021-03-11 — — 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-20210070784-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME NAMPT, NNT, NAPRT KMT2A 770/4885CYP19A1 3090/4885GPR35 2520/4885
US-20230124268-A1 NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE INHIBITORS AND METHODS FOR USE OF THE SAME NAMPT, NNT, NAPRT KMT2A 770/4885CYP19A1 3090/4885GPR35 2520/4885
US-11584766-B2 Nicotinamide phosphoribosyltransferase inhibitors and methods for use of the same NAMPT, NNT, NAPRT KMT2A 770/4885CYP19A1 3090/4885GPR35 2520/4885

“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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