SCHEMBL22554035

SCHEMBL22554035

Cn1cc(-c2cncc(-c3ccc(N4CCCC4=O)cc3)c2)ccc1=O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 7/20 0.53
BMPR1A P36894 7/20 0.53
ACVRL1 P37023 7/20 0.53
ACVR1 Q04771 7/20 0.53
TGFBR1 P36897 5/20 0.45
CCNC P24863 2/20 0.43
CDK8 P49336 2/20 0.43
CHEK1 O14757 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.42
BRD4 O60885 1/20 0.41
BRDT Q58F21 1/20 0.41
SYK P43405 2/20 0.41
CYP11B2 P19099 3/20 0.41
CYP11B1 P15538 2/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL28559152 0.85 CCNC (0.43) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL22553833 0.84 SYK (0.42) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL22553727 0.82 ALDH1A1 (0.48) CHEK1ALDH1A1NPC1CYP11B2CYP11B1
SCHEMBL30730791 0.82 ALDH1A1 (0.48) CHEK1ALDH1A1NPC1CYP11B2CYP11B1
SCHEMBL22578402 0.80 CHEK1 (0.41) CCNCCDK8CHEK1ALDH1A1NPC1
SCHEMBL28559252 0.79 NPC1 (0.45) CCNCCDK8CHEK1ALDH1A1NPC1
SCHEMBL14908919 0.78 NPC1 (0.60) CCNCCDK8ALDH1A1NPC1CYP11B2
SCHEMBL28560413 0.78 SYK (0.45) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL22554063 0.78 BRD4 (0.45) CCNCCDK8CHEK1ALDH1A1NPC1
SCHEMBL28563345 0.78 NPC1 (0.40) BMPR1BBMPR1AACVRL1ACVR1CCNC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN claimed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 US claimed
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2024-03-05 US disclosed
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 US disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 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 (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-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1A, PIP5K1B, PIP5K1C BMPR1B 3661/4885BMPR1A 2953/4885ACVRL1 3919/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C BMPR1B 3661/4885BMPR1A 2953/4885ACVRL1 3919/4885

“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.