SCHEMBL19952906

SCHEMBL19952906

CC(=O)c1c(-c2ccccc2)c2cc(C)ccc2[nH]c1=O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 5/20 0.73
KDM4E B2RXH2 6/20 0.67
ALDH1A1 P00352 5/20 0.67
HSD17B10 Q99714 3/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
HPGD P15428 2/20 0.67
HTT P42858 1/20 0.67
GFER P55789 1/20 0.67
PIM1 P11309 1/20 0.65
MAPK10 P53779 1/20 0.60
IKBKB O14920 1/20 0.59
CHUK O15111 1/20 0.59
AKT1 P31749 1/20 0.59
AKT2 P31751 1/20 0.59
AKT3 Q9Y243 1/20 0.59
NPSR1 Q6W5P4 1/20 0.58
CSF1R P07333 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL29612310 1.00 PADI4 (0.73) PADI4KDM4EALDH1A1HSD17B10MEN1
SCHEMBL22899476 0.87 PADI4 (0.57) PADI4KDM4EALDH1A1HSD17B10MEN1
SCHEMBL30043560 0.85 MAP2 (0.74) PADI4KDM4EALDH1A1HPGDPIM1
SCHEMBL6059495 0.85 MAP2 (0.74) PADI4KDM4EALDH1A1HPGDPIM1
SCHEMBL16112039 0.85 MEN1 (0.76) PADI4KDM4EALDH1A1HSD17B10MEN1
SCHEMBL19952854 0.85 PADI4 (0.64) PADI4MEN1KMT2ACSF1RMAP2
SCHEMBL29612191 0.85 PADI4 (0.64) PADI4MEN1KMT2ACSF1RMAP2
SCHEMBL19952768 0.85 PADI4 (1.00) PADI4KDM4EALDH1A1HSD17B10MEN1
SCHEMBL19952955 0.84 KDM4E (0.68) PADI4KDM4EALDH1A1HPGDIKBKB
SCHEMBL29612100 0.84 KDM4E (0.68) PADI4KDM4EALDH1A1HPGDIKBKB

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-3510025-B1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2022-06-29 EP disclosed
CN-110248934-B Heteroaryl PAD4 inhibitors 帕德罗科治疗公司 2022-05-24 CN disclosed
US-20210299115-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-09-30 US disclosed
US-20210299115-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS INC (US) 2021-09-30 US disclosed
US-11026937-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-06-08 US disclosed
US-11026937-B2 Heteroaryl inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2021-06-08 US disclosed
EP-3510025-A1 HETEROARYL INHIBITORS OF PAD4 Padlock Therapeutics, Inc. (US) 2019-07-17 EP disclosed
WO-2018049296-A1 HETEROARYL INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. (US) 2018-03-15 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 (2 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-20210299115-A1 HETEROARYL INHIBITORS OF PAD4 PADI4, PADI1, PADI6 PADI4 1/4885KDM4E 117/4885ALDH1A1 956/4885
US-11026937-B2 Heteroaryl inhibitors of PAD4 PADI4, PADI1, PADI6 PADI4 1/4885KDM4E 117/4885ALDH1A1 956/4885

“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.