SCHEMBL18940654

SCHEMBL18940654

CCNc1c(N)cc(C(=O)O)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ GAA P10253 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ PLEC Q15149 1/20 0.51
▸ CA12 O43570 2/20 0.49
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ CA4 P22748 2/20 0.49
▸ CA6 P23280 2/20 0.49
▸ CA7 P43166 2/20 0.49
▸ CA9 Q16790 2/20 0.49
▸ CA14 Q9ULX7 2/20 0.49
▸ CA3 P07451 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ CA5A P35218 1/20 0.49

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
SCHEMBL29850635 1.00 HTT (0.51) HTTALDH1A1GAAKDM4EMAPT
SCHEMBL18969570 0.88 KDM4E (0.45) HTTALDH1A1GAAKDM4EMAPT
SCHEMBL29850871 0.88 KDM4E (0.45) HTTALDH1A1GAAKDM4EMAPT
SCHEMBL28306097 0.83 CA12 (0.53) HTTALDH1A1KDM4ECA12CA1
SCHEMBL20886126 0.82 PDE4A (0.47) HTTALDH1A1GAAKDM4EMAPT
SCHEMBL18976653 0.81 CA12 (0.47) HTTALDH1A1GAAKDM4EMAPT
SCHEMBL19437435 0.77 ALDH1A1 (0.46) HTTALDH1A1GAATSHRLMNA
SCHEMBL20886127 0.76 ALDH1A1 (0.44) ALDH1A1GAAKDM4EMAPT
SCHEMBL10687263 0.76 MAPT (0.51) ALDH1A1GAAKDM4EMAPTGFER
SCHEMBL21723148 0.75 CA12 (0.51) HTTALDH1A1GAAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3885342-B1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2024-11-20 — — EP disclosed
CN-109069869-B Bicyclic PAD4 inhibitors 帕德罗科治疗公司 2022-09-13 — — CN disclosed
EP-3885342-A1 BICYCLIC INHIBITORS OF PAD4 Padlock Therapeutics, Inc. (US) 2021-09-29 — — EP disclosed
EP-3386590-B1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-06-02 — — EP disclosed
EP-3386590-A1 BICYCLIC INHIBITORS OF PAD4 Padlock Therapeutics, Inc. (US) 2018-10-17 — — EP disclosed
US-9963448-B2 Bicyclic inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2018-05-08 — — US disclosed
WO-2017100594-A1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-06-15 — — WO disclosed
US-20170166565-A1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. 2017-06-15 — — 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 (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-20170166565-A1 BICYCLIC INHIBITORS OF PAD4 PADI4, PADI1, PADI2 HTT 3840/4885ALDH1A1 955/4885GAA 1075/4885

“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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