SCHEMBL11082247

SCHEMBL11082247

Cn1c(S)cc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ DAO P14920 1/20 0.50
▸ MCL1 Q07820 1/20 0.50
▸ MAPT P10636 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ BRD4 O60885 1/20 0.47
▸ BRPF1 P55201 1/20 0.47
▸ KAT2B Q92831 1/20 0.47
▸ BRD9 Q9H8M2 1/20 0.47
▸ TERT O14746 1/20 0.46
▸ SLC9A1 P19634 1/20 0.42
▸ ADRA2A P08913 1/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ GRIN2D O15399 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
SCHEMBL10103705 0.76 KMT2A (0.76) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL154592 0.74 KMT2A (0.55) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL29378766 0.74 KMT2A (0.55) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL5640746 0.74 GRIN2D (0.53) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL4177987 0.73 KMT2A (0.53) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL9668718 0.73 KMT2A (0.53) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL17207662 0.73 KMT2A (0.53) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL3635550 0.73 DAO (0.60) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL687508 0.73 KMT2A (0.53) KMT2ADAOMCL1MAPTALDH1A1
SCHEMBL15417040 0.73 KMT2A (0.53) KMT2ADAOMCL1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11312733-B2 Silylated derivatives of aromatic heterocycles CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2022-04-26 — — US disclosed
US-10975084-B2 KDM5 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-04-13 — — US disclosed
US-20210047348-A1 Silylated Derivatives Of Aromatic Heterocycles CALIFORNIA INSTITUTE OF TECHNOLOGY 2021-02-18 — — US disclosed
EP-0121499-A2 Cephalosporins, their preparation and pharmaceutical compositions CIBA-GEIGY AG (CH) 1984-10-10 — — EP disclosed
EP-0092830-A2 Cephalosporin derivatives, process for their preparation, pharmaceutical compositions containing them and their application CIBA-GEIGY AG (CH) 1983-11-02 — — EP disclosed
EP-0076452-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1983-04-13 — — EP disclosed
EP-0070803-A2 Antibiotically active aminotriazolylcephalosporin derivatives and their preparation CIBA-GEIGY AG (CH) 1983-01-26 — — 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 (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-11312733-B2 Silylated derivatives of aromatic heterocycles KCNH1, KCNH3, HNRNPH3 KMT2A 654/4885DAO 3351/4885MCL1 815/4885
US-20210047348-A1 Silylated Derivatives Of Aromatic Heterocycles KCNH1, KCNH3, HNRNPH3 KMT2A 654/4885DAO 3351/4885MCL1 815/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C KMT2A 26/4885DAO 3196/4885MCL1 645/4885

“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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