SCHEMBL22658449

SCHEMBL22658449

CCC(C)Nc1nc(Nc2ccc(S(=O)(=O)N3CCOCC3)cc2OC)nc2[nH]cc(Cl)c12

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 8/20 0.57
▸ KMT2A Q03164 1/20 0.49
▸ PTK2 Q05397 2/20 0.44
▸ TTK P33981 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ ZAP70 P43403 1/20 0.42

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
SCHEMBL22658448 1.00 LRRK2 (0.57) LRRK2KMT2APTK2TTKALDH1A1
SCHEMBL24556827 1.00 LRRK2 (0.57) LRRK2KMT2APTK2TTKALDH1A1
SCHEMBL29409884 1.00 LRRK2 (0.57) LRRK2KMT2APTK2TTKALDH1A1
SCHEMBL29409860 1.00 LRRK2 (0.57) LRRK2KMT2APTK2TTKALDH1A1
SCHEMBL24556814 0.94 LRRK2 (0.53) LRRK2KMT2APTK2TTKZAP70
SCHEMBL24556858 0.94 LRRK2 (0.53) LRRK2KMT2APTK2TTKZAP70
SCHEMBL29409886 0.94 LRRK2 (0.53) LRRK2KMT2APTK2TTKZAP70
SCHEMBL29409850 0.94 LRRK2 (0.53) LRRK2KMT2APTK2TTKZAP70
SCHEMBL24059629 0.90 LRRK2 (0.60) LRRK2KMT2APTK2
SCHEMBL25107242 0.90 TTK (0.53) LRRK2KMT2APTK2TTKALDH1A1

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-12479847-B2 Pyrrolopyrimidine inhibitors of wild-type and mutant forms of LRRK2 DANA-FARBER CANCER INSTITUTE, INC. (US) 2025-11-25 — — US disclosed
US-20220204515-A1 PYRROLOPYRIMIDINE INHIBITORS OF WILD-TYPE AND MUTANT FORMS OF LRRK2 DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-30 — — US disclosed
WO-2020232332-A1 PYRROLOPYRIMIDINE INHIBITORS OF WILD-TYPE AND MUTANT FORMS OF LRRK2 DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-11-19 — — 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-20220204515-A1 PYRROLOPYRIMIDINE INHIBITORS OF WILD-TYPE AND MUTANT FORMS OF LRRK2 LRRK2, PARK7, PINK1 LRRK2 1/4885KMT2A 1326/4885PTK2 533/4885
US-12479847-B2 Pyrrolopyrimidine inhibitors of wild-type and mutant forms of LRRK2 LRRK2, PARK7, PINK1 LRRK2 1/4885KMT2A 1326/4885PTK2 533/4885

“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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