SCHEMBL21883489

SCHEMBL21883489

O=c1[nH]c(Cl)nc2ncn(Cc3ccc(-c4ccccc4)cc3)c12

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
ALDH1A1 P00352 2/20 0.56
KMT2A Q03164 1/20 0.55
HPGD P15428 1/20 0.53
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
EGLN1 Q9GZT9 2/20 0.43
PNP P00491 2/20 0.43
PARN O95453 1/20 0.43
CNOT7 Q9UIV1 1/20 0.43
DAO P14920 1/20 0.42
BRD4 O60885 2/20 0.42
ADORA3 P0DMS8 1/20 0.41
GAA P10253 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
SCHEMBL7111111 0.86 PNP (0.56) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
Hydrochloric Acid SCHEMBL7114730 0.85 PNP (0.55) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL7973932 0.84 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL7991402 0.83 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL7975265 0.82 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1KMT2AHPGDPNP
SCHEMBL9905498 0.81 HPGD (0.47) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL7984453 0.81 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1KMT2AHPGDPNP
SCHEMBL7984716 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL7986518 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1KMT2AHPGDCYP11B1
SCHEMBL3426471 0.78 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1KMT2AHPGDPNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12157739-B2 Hypoxanthine compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 2024-12-03 US disclosed
CN-112673008-B Hypoxanthine compounds 橘生药品工业株式会社 2023-07-18 CN disclosed
US-20210214357-A1 HYPOXANTHINE COMPOUNDS KISSEI PHARMACEUTICAL CO., LTD. (JP) 2021-07-15 US disclosed
CN-112673008-A Hypoxanthine compound 橘生药品工业株式会社 2021-04-16 CN disclosed
WO-2020054825-A1 HYPOXANTHINE COMPOUND キッセイ薬品工業株式会社 2020-03-19 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 (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-12157739-B2 Hypoxanthine compounds HPRT1, APRT, IMPDH1 SMN1; SMN2 1846/4885ALDH1A1 108/4885KMT2A 297/4885
US-20210214357-A1 HYPOXANTHINE COMPOUNDS HPRT1, DHPS, PAH SMN1; SMN2 3418/4885ALDH1A1 174/4885KMT2A 168/4885

“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.