SCHEMBL17322837

SCHEMBL17322837

COC(=O)Cn1nc(-c2ccccc2F)c2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.69
▸ SMN1; SMN2 Q16637 3/20 0.69
▸ LMNA P02545 2/20 0.69
▸ ALDH1A1 P00352 2/20 0.69
▸ HPGD P15428 2/20 0.69
▸ KMT2A Q03164 2/20 0.69
▸ HTT P42858 1/20 0.69
▸ MAPT P10636 3/20 0.52
▸ TSHR P16473 2/20 0.51
▸ HSD17B10 Q99714 3/20 0.48
▸ RORC P51449 1/20 0.46
▸ BUB1 O43683 1/20 0.43
▸ GAA P10253 2/20 0.42
▸ POLB P06746 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
SCHEMBL17322846 0.92 KDM4E (0.65) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322884 0.88 KDM4E (0.63) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322845 0.88 KDM4E (0.63) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322840 0.88 KDM4E (0.69) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322887 0.87 KMT2A (0.62) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15631862 0.86 KDM4E (0.70) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15631845 0.86 KDM4E (0.70) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322866 0.86 KDM4E (0.63) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15631848 0.85 KDM4E (0.69) KDM4ESMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL17322839 0.85 KDM4E (0.69) KDM4ESMN1; SMN2LMNAALDH1A1HPGD

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
US-9738610-B2 Indazole derivatives and uses thereof WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2017-08-22 — — US disclosed
US-9738610-B2 Indazole derivatives and uses thereof WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2017-08-22 — — US disclosed
US-20150353503-A1 INDAZOLE DERIVATIVES AND USES THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-12-10 — — US disclosed
US-20150353503-A1 INDAZOLE DERIVATIVES AND USES THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-12-10 — — 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 (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-20150353503-A1 INDAZOLE DERIVATIVES AND USES THEREOF CYP11B1, HSP90B1, CYP1B1 KDM4E 4525/4885SMN1; SMN2 4794/4885LMNA 3513/4885

“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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