SCHEMBL14376375

SCHEMBL14376375

Cc1[nH]c(/C=C2\C(=O)Nc3ccc(OC(F)(F)F)cc32)nc1S(C)(=O)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 4/20 0.59
▸ CES1 P23141 1/20 0.51
▸ TLK2 Q86UE8 5/20 0.44
▸ TGM2 P21980 1/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ ABL1 P00519 2/20 0.42
▸ CA1 P00915 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ LRRK2 Q5S007 2/20 0.42
▸ CDK1 P06493 2/20 0.40
▸ CDK2 P24941 2/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ KDR P35968 2/20 0.40
▸ GSK3A P49840 2/20 0.40
▸ GSK3B P49841 2/20 0.40
▸ CDK7 P50613 2/20 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
SCHEMBL14376360 0.88 TLK2 (0.58) RETTLK2NPC1LMNAMAPT
SCHEMBL14376388 0.85 TLK2 (0.60) RETTLK2NPC1LMNAMAPT
SCHEMBL14376362 0.85 TLK2 (0.47) RETTLK2NPC1LMNAMAPT
SCHEMBL14376379 0.83 MEN1 (0.53) TLK2CDK2KDRAURKAFGFR1
SCHEMBL14376381 0.82 SRC (0.46) RETNPC1LMNAMAPTRAB9A
SCHEMBL14376382 0.81 RET (0.55) RETTGM2LRRK2RPS6KA3PDGFRB
SCHEMBL14376455 0.81 RET (0.56) RETCES1TLK2TGM2NPC1
SCHEMBL14375876 0.80 RET (0.65) RETCES1TLK2TGM2NPC1
SCHEMBL14375862 0.79 RET (0.67) RETCES1TLK2TGM2NPC1
SCHEMBL14375852 0.75 LRRK2 (0.72) RETCES1TLK2TGM2NPC1

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 789/4885CES1 4336/4885TLK2 35/4885

“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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