SCHEMBL12263159

SCHEMBL12263159

CC(C)c1sc2cc(F)ccc2c1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCKDK O14874 1/20 0.51
▸ RAB9A P51151 4/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ SENP1 Q9P0U3 1/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TLR3 O15455 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ PTGS1 P23219 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ GPER1 Q99527 1/20 0.38
▸ LMNA P02545 4/20 0.38
▸ RECQL P46063 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL12678220 0.88 BCKDK (0.38) BCKDKRAB9AKDM4EALOX5MPI
SCHEMBL19304403 0.84 BCKDK (0.47) BCKDKRAB9AKDM4ESENP1SMN1; SMN2
SCHEMBL12896176 0.81 BCKDK (0.38) BCKDKRAB9AKDM4EALDH1A1LMNA
SCHEMBL16075899 0.81 BCKDK (0.38) BCKDKRAB9AKDM4ESMN1; SMN2NPC1
SCHEMBL12310725 0.77 BCKDK (0.56) BCKDKRAB9AKDM4ESENP1SMN1; SMN2
SCHEMBL31053344 0.76 BCKDK (0.46) BCKDKRAB9AKDM4ESENP1SMN1; SMN2
SCHEMBL31053377 0.75 BCKDK (0.45) BCKDKRAB9AKDM4ESENP1SMN1; SMN2
SCHEMBL31053357 0.75 BCKDK (0.45) BCKDKRAB9AKDM4ESENP1SMN1; SMN2
SCHEMBL12767846 0.74 ALOX5 (0.56) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL13659611 0.73 BCKDK (0.68) BCKDKRAB9AKDM4ESENP1SMN1; SMN2

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
US-20230043959-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE CORPORATION 2023-02-09 — — US disclosed
US-20200397774-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE HOLDINGS CORPORATION 2020-12-24 — — US disclosed
US-10695337-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors INCYTE HOLDINGS CORPORATION (US) 2020-06-30 — — US disclosed
US-20170246157-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE CORPORATION 2017-08-31 — — US disclosed
US-20170137425-A1 TRICYCLIC COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL MYERS SQUIBB CO (US) 2017-05-18 — — US disclosed
US-9464088-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-10-11 — — US disclosed
US-8765734-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors INCYTE CORPORATION (US) 2014-07-01 — — US disclosed
US-20110224190-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE CORPORATION 2011-09-15 — — 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 (6 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-20200397774-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 BCKDK 4303/4885RAB9A 708/4885KDM4E 248/4885
US-20170246157-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 BCKDK 4303/4885RAB9A 708/4885KDM4E 248/4885
US-20110224190-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 BCKDK 4303/4885RAB9A 708/4885KDM4E 248/4885
US-20170137425-A1 TRICYCLIC COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA6, CHRNA5 BCKDK 2907/4885RAB9A 1218/4885KDM4E 4325/4885
US-20230043959-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS JAK1, JAK2, JAK3 BCKDK 4273/4885RAB9A 693/4885KDM4E 347/4885
US-10695337-B2 Piperidin-4-yl azetidine derivatives as JAK1 inhibitors JAK1, JAK2, JAK3 BCKDK 4303/4885RAB9A 708/4885KDM4E 248/4885

“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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