SCHEMBL14375855

SCHEMBL14375855

Cc1nnc(/C=C2\C(=O)Nc3ccc(Cl)cc32)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.60
▸ LRRK2 Q5S007 8/20 0.57
▸ PSEN1 P49768 2/20 0.54
▸ PSEN2 P49810 2/20 0.54
▸ APH1B Q8WW43 2/20 0.54
▸ NCSTN Q92542 2/20 0.54
▸ APH1A Q96BI3 2/20 0.54
▸ PSENEN Q9NZ42 2/20 0.54
▸ IDO1 P14902 1/20 0.53
▸ TDO2 P48775 1/20 0.53
▸ TGM2 P21980 1/20 0.53
▸ PDGFRB P09619 2/20 0.53
▸ RPS6KA3 P51812 1/20 0.52
▸ EGFR P00533 1/20 0.51
▸ ERBB2 P04626 1/20 0.51
▸ MDM2 Q00987 3/20 0.50

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
SCHEMBL14376386 0.85 MEN1 (0.58) PDGFRBRPS6KA3
SCHEMBL14376565 0.82 TLK2 (0.64) RETLRRK2PDGFRBRPS6KA3MDM2
SCHEMBL14375877 0.81 SRC (0.47) RETPDGFRBEGFR
SCHEMBL14375845 0.81 RET (0.62) RETLRRK2PSEN1PSEN2APH1B
SCHEMBL14375848 0.80 LRRK2 (0.68) RETLRRK2PDGFRBRPS6KA3MDM2
SCHEMBL14375850 0.80 TLK2 (0.52) RETLRRK2PSEN1PSEN2APH1B
SCHEMBL14375876 0.79 RET (0.65) RETLRRK2TGM2PDGFRBRPS6KA3
SCHEMBL15879182 0.79 NPC1 (0.69) RETLRRK2PSEN1PSEN2APH1B
SCHEMBL14375860 0.79 NPC1 (0.69) RETLRRK2PSEN1PSEN2APH1B
SCHEMBL14376382 0.77 RET (0.55) RETLRRK2PSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 — — US disclosed
WO-2012178015-A2 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2012-12-27 — — 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 (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-20140205537-A1 LRRK2 INHIBITORS LRRK2, PARK7, MAP2 RET 789/4885LRRK2 1/4885PSEN1 504/4885

“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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