SCHEMBL19284336

SCHEMBL19284336

C=Cc1cnccc1C(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ GLA P06280 2/20 0.58
▸ GAA P10253 2/20 0.58
▸ LMNA P02545 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ TSHR P16473 2/20 0.44
▸ KMT2A Q03164 1/20 0.41
▸ CYP46A1 Q9Y6A2 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ HTT P42858 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ NCOA1 Q15788 1/20 0.39
▸ RCE1 Q9Y256 1/20 0.39
▸ NCOA3 Q9Y6Q9 1/20 0.39
▸ AXL P30530 1/20 0.39
▸ MAP2K1 Q02750 1/20 0.39

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
SCHEMBL31584153 1.00 KDM4E (0.58) KDM4EALDH1A1GLAGAALMNA
SCHEMBL22216857 0.87 KDM4E (0.54) KDM4EALDH1A1GLAGAALMNA
SCHEMBL30465534 0.87 KDM4E (0.54) KDM4EALDH1A1GLAGAALMNA
SCHEMBL28266315 0.83 ALDH1A1 (0.40) KDM4EALDH1A1GLAGAALMNA
SCHEMBL26599922 0.81 KDM4E (0.49) KDM4EALDH1A1GLAGAALMNA
SCHEMBL9000436 0.81 KDM4E (0.55) KDM4EALDH1A1GLAGAALMNA
SCHEMBL29792739 0.80 KDM4E (0.54) KDM4EALDH1A1GLAGAALMNA
SCHEMBL19839823 0.80 KDM4E (0.54) KDM4EALDH1A1GLAGAALMNA
SCHEMBL19839824 0.80 KDM4E (0.54) KDM4EALDH1A1GLAGAALMNA
SCHEMBL21056702 0.79 KDM4C (0.53) KDM4EALDH1A1GAAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11897866-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2024-02-13 — — US disclosed
US-20220081418-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2022-03-17 — — US disclosed
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-12-14 — — US disclosed
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-12-14 — — US disclosed
CN-109071497-B PAD4 heteroaryl inhibitors 帕德罗科治疗公司 2021-10-22 — — CN disclosed
US-20210188810-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-06-24 — — US disclosed
US-20210188810-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-06-24 — — US disclosed
EP-3419969-A1 HETEROARYL INHIBITORS OF PAD4 Padlock Therapeutics, Inc. (US) 2019-01-02 — — EP disclosed
WO-2017147102-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-08-31 — — WO disclosed
WO-2017147102-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-08-31 — — WO disclosed
CN-105980378-A Sulfamoyl pyrrole amide derivative and application thereof as medicine for treating hepatitis B 爱尔兰詹森科学公司 2016-09-28 — — CN 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 (4 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-20210188810-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 KDM4E 117/4885ALDH1A1 956/4885GLA 3805/4885
US-11897866-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 KDM4E 117/4885ALDH1A1 956/4885GLA 3805/4885
US-20220081418-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 KDM4E 117/4885ALDH1A1 956/4885GLA 3805/4885
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 KDM4E 117/4885ALDH1A1 956/4885GLA 3805/4885

“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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