SCHEMBL19284316

SCHEMBL19284316

O=Cc1cnc(-c2ccccc2)n1CC1CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ LMNA P02545 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KDM4E B2RXH2 4/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PADI4 Q9UM07 5/20 0.37
▸ CHEK1 O14757 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ LIMK1 P53667 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ GRIN1 Q05586 5/20 0.36
▸ GRIN2B Q13224 5/20 0.36
▸ ABCC1 P33527 1/20 0.35
▸ KDM2B Q8NHM5 1/20 0.35

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
SCHEMBL4030659 0.79 KDM4E (0.54) ALDH1A1KDM4EHSD17B10CHEK1MAPT
SCHEMBL19301627 0.79 KDM4E (0.43) ALDH1A1LMNAL3MBTL1KDM4EHSD17B10
SCHEMBL3018678 0.78 KDM4E (0.40) ALDH1A1LMNAL3MBTL1KDM4EHSD17B10
SCHEMBL19301734 0.75 KDM4E (0.40) ALDH1A1LMNAL3MBTL1KDM4EHSD17B10
SCHEMBL19301796 0.75 PADI4 (0.42) ALDH1A1KDM4EHSD17B10NPSR1PADI4
SCHEMBL650017 0.74 TSHR (0.56) ALDH1A1L3MBTL1KDM4EHSD17B10TDP1
SCHEMBL6968342 0.73 ALDH1A1 (0.47) ALDH1A1LMNAL3MBTL1HSD17B10MAPT
SCHEMBL19284354 0.72 LMNA (0.45) ALDH1A1LMNAKDM4EPADI4GRIN1
SCHEMBL474103 0.72 HPGDS (0.51) ALDH1A1LMNAKDM4EHSD17B10CHEK1
SCHEMBL19301633 0.69 TDP1 (0.46) ALDH1A1LMNAL3MBTL1KDM4EHSD17B10

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 10 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
CN-109071497-A PAD4 heteroaryl inhibitors 帕德罗科治疗公司 2018-12-21 — — CN disclosed
WO-2017147102-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-08-31 — — 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 (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 ALDH1A1 956/4885LMNA 3266/4885L3MBTL1 1462/4885
US-11897866-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 ALDH1A1 956/4885LMNA 3266/4885L3MBTL1 1462/4885
US-20220081418-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 ALDH1A1 956/4885LMNA 3266/4885L3MBTL1 1462/4885
US-11198681-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 ALDH1A1 956/4885LMNA 3266/4885L3MBTL1 1462/4885

“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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