SCHEMBL29636289

SCHEMBL29636289

Cc1cc(OC(C)C)ccc1B(O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ PARP10 Q53GL7 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ ACACB O00763 2/20 0.40
▸ ACACA Q13085 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ NPY1R P25929 1/20 0.39
▸ NPY2R P49146 1/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ BRPF1 P55201 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL15193542 1.00 ALDH1A1 (0.46) ALDH1A1TDP1KMT2APARP10KDM4E
SCHEMBL25408444 0.83 LMNA (0.43) ALDH1A1TDP1KMT2AKDM4EMAPT
SCHEMBL29956410 0.80 ALDH1A1 (0.40) ALDH1A1TDP1KMT2APARP10KDM4E
SCHEMBL30110746 0.80 IGLV6-57 (0.49) TDP1KMT2ABRD4MEN1
SCHEMBL29952540 0.79 ALDH1A1 (0.44) ALDH1A1KMT2APARP10KDM4EHPGD
SCHEMBL20659060 0.79 ALDH1A1 (0.44) ALDH1A1KMT2APARP10POLBGLA
SCHEMBL3606391 0.79 ALDH1A1 (0.44) ALDH1A1KMT2APARP10KDM4EHPGD
SCHEMBL29636290 0.79 ALDH1A1 (0.44) ALDH1A1KMT2APARP10POLBGLA
SCHEMBL42032 0.78 CA1 (0.50) ALDH1A1TDP1KMT2AKDM4EMAPT
SCHEMBL29636771 0.78 CA1 (0.50) ALDH1A1TDP1KMT2AKDM4EMAPT

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-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2023-09-28 — — US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
US-20220281825-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ARENAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2022-09-08 — — US disclosed
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus ARISAN THERAPEUTICS INC. (US) 2022-06-07 — — 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-20220281825-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ARENAVIRUS INFECTION C9, C1S, ZC3HAV1 ALDH1A1 1131/4885TDP1 3293/4885KMT2A 1651/4885
US-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS C3AR1, C9, C1R ALDH1A1 514/4885TDP1 3576/4885KMT2A 2960/4885
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus C9, C1R, C1S ALDH1A1 1146/4885TDP1 2996/4885KMT2A 1493/4885

“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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