SCHEMBL21225377

SCHEMBL21225377

O=C(N[C@@H]1CCCNC1)c1cc2cc(Cl)c(F)c(F)c2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.49
▸ MLLT1 Q03111 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ PBK Q96KB5 6/20 0.43
▸ CHEK1 O14757 8/20 0.42
▸ CHRNA1 P02708 1/20 0.41
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNB4 P30926 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ CCNA2 P20248 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ NTRK1 P04629 1/20 0.40
▸ CDK2AP1 O14519 1/20 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
SCHEMBL21225769 1.00 SYK (0.49) SYKMLLT1MAPK1OPRK1PBK
SCHEMBL21225379 1.00 SYK (0.49) SYKMLLT1MAPK1OPRK1PBK
SCHEMBL21225618 0.93 SYK (0.43) SYKMLLT1PBK
SCHEMBL21225620 0.93 SYK (0.43) SYKMLLT1PBK
SCHEMBL21225690 0.93 SYK (0.43) SYKMLLT1PBK
SCHEMBL21225682 0.88 MLLT1 (0.41) SYKMLLT1
SCHEMBL29990642 0.88 MLLT1 (0.41) SYKMLLT1
SCHEMBL25531945 0.83 SYK (0.41) SYKMLLT1PBKCCNA2CDK2
SCHEMBL25531884 0.83 SYK (0.41) SYKMLLT1PBK
SCHEMBL21225574 0.81 TAS1R3 (0.38) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018033-B2 Inhibitors of protein arginine deiminases FORWARD THERAPEUTICS, INC. (US) 2024-06-25 — — US claimed
US-11453676-B2 Inhibitors of protein arginine deiminases FORWARD THERAPEUTICS, INC. (US) 2022-09-27 — — US claimed
US-20210053975-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2021-02-25 — — US claimed
EP-3746430-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES Padforward LLC (US) 2020-12-09 — — EP claimed
WO-2019152883-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES PADFORWARD LLC (US) 2019-08-08 — — WO claimed
US-12018033-B2 Inhibitors of protein arginine deiminases FORWARD THERAPEUTICS, INC. (US) 2024-06-25 — — US disclosed
US-20230151018-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2023-05-18 — — US disclosed
US-20230151018-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2023-05-18 — — US disclosed
US-20230151018-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2023-05-18 — — US disclosed
US-11453676-B2 Inhibitors of protein arginine deiminases FORWARD THERAPEUTICS, INC. (US) 2022-09-27 — — US disclosed
US-20210053975-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2021-02-25 — — US disclosed
US-20210053975-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES FORWARD THERAPEUTICS, INC. 2021-02-25 — — US disclosed
WO-2019152883-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES PADFORWARD LLC (US) 2019-08-08 — — 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-20230151018-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES PADI2, PADI1, PADI4 SYK 2709/4885MLLT1 858/4885MAPK1 2912/4885
US-11453676-B2 Inhibitors of protein arginine deiminases PADI2, PADI1, PADI4 SYK 2693/4885MLLT1 987/4885MAPK1 2197/4885
US-20210053975-A1 INHIBITORS OF PROTEIN ARGININE DEIMINASES PADI2, PADI1, PADI4 SYK 2709/4885MLLT1 858/4885MAPK1 2912/4885
US-12018033-B2 Inhibitors of protein arginine deiminases PADI2, PADI1, PADI4 SYK 2547/4885MLLT1 1129/4885MAPK1 2202/4885

“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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