SCHEMBL22648372

SCHEMBL22648372

C[S+]([O-])c1ncc(C(F)(F)F)c(NCCCN2CCCC2=O)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ PGK1 P00558 1/20 0.45
▸ ALDH1A1 P00352 9/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ ULK1 O75385 1/20 0.44
▸ ULK2 Q8IYT8 1/20 0.44
▸ KDM4E B2RXH2 7/20 0.42
▸ LMNA P02545 3/20 0.42
▸ IRAK4 Q9NWZ3 2/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ HPGD P15428 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ CYP1A2 P05177 2/20 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
SCHEMBL22634663 0.97 SMN1; SMN2 (0.47) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL22659280 0.96 SMN1; SMN2 (0.46) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL22635587 0.96 SMN1; SMN2 (0.46) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL22634545 0.89 ULK1 (0.56) SMN1; SMN2HTTPGK1ULK1ULK2
SCHEMBL22648425 0.88 ULK1 (0.43) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL22648323 0.86 ULK1 (0.39) SMN1; SMN2HTTULK1ULK2IRAK4
SCHEMBL22648404 0.86 ULK1 (0.48) SMN1; SMN2HTTULK1ULK2LMNA
SCHEMBL22672870 0.83 SMN1; SMN2 (0.51) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL27087788 0.83 SMN1; SMN2 (0.51) SMN1; SMN2HTTPGK1ALDH1A1MEN1
SCHEMBL22652222 0.82 ULK1 (0.36) SMN1; SMN2HTTULK1ULK2IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3966206-B1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS LLC (US) 2023-08-09 — — EP disclosed
US-20230047915-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-02-16 — — US disclosed
US-20230039712-A1 PHENYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-02-09 — — US disclosed
US-11530206-B2 Phenylaminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2022-12-20 — — US disclosed
US-11518758-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof DECIPHERA PHARMACEUTICALS, LLC (US) 2022-12-06 — — US disclosed
US-20200354346-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2020-11-12 — — US disclosed
US-20200354352-A1 PHENYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2020-11-12 — — 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-20230039712-A1 PHENYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 SMN1; SMN2 3477/4885HTT 927/4885PGK1 237/4885
US-20230047915-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 SMN1; SMN2 3749/4885HTT 630/4885PGK1 568/4885
US-11530206-B2 Phenylaminopyrimidine amide autophagy inhibitors and methods of use thereof BECN1, SQSTM1, ATG7 SMN1; SMN2 3477/4885HTT 927/4885PGK1 237/4885
US-20200354352-A1 PHENYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 SMN1; SMN2 3477/4885HTT 927/4885PGK1 237/4885
US-20200354346-A1 HETEROARYLAMINOPYRIMIDINE AMIDE AUTOPHAGY INHIBITORS AND METHODS OF USE THEREOF BECN1, SQSTM1, ATG7 SMN1; SMN2 3749/4885HTT 630/4885PGK1 568/4885
US-11518758-B2 Heteroarylaminopyrimidine amide autophagy inhibitors and methods of use thereof BECN1, SQSTM1, ATG7 SMN1; SMN2 3749/4885HTT 630/4885PGK1 568/4885

“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.

Send feedback