SCHEMBL22105271

SCHEMBL22105271

CCOC(=O)c1cnn2c(Cl)c(F)c(Cl)nc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.54
ALDH1A1 P00352 7/20 0.54
HSD17B10 Q99714 6/20 0.54
HPGD P15428 5/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
CASP1 P29466 3/20 0.48
CASP7 P55210 2/20 0.48
TSHR P16473 2/20 0.48
GAA P10253 3/20 0.47
MAPT P10636 2/20 0.47
GLA P06280 1/20 0.47
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
CSNK1D P48730 3/20 0.46
KLK7 P49862 1/20 0.45
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 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
SCHEMBL17781277 0.87 KDM4E (0.53) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL21961701 0.84 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL19680296 0.82 KDM4E (0.55) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL25117818 0.81 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL28489390 0.81 KDM4E (0.46) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL25117830 0.80 ALDH1A1 (0.62) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL20697060 0.80 KDM4E (0.64) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL25177366 0.79 SMN1; SMN2 (0.50) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL25177371 0.79 KDM4E (0.54) KDM4EALDH1A1HSD17B10HPGDNPC1
SCHEMBL23516462 0.79 TP53 (0.37) KDM4EALDH1A1HSD17B10HPGDNPC1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112110938-A Compound as protein kinase inhibitor and preparation method and application thereof 成都海博为药业有限公司 2020-12-22 CN claimed
US-20250270222-A1 AP2 ASSOCIATED KINASE 1 INHIBITORS AND USES THEREOF SATELLOS BIOSCIENCE INC. (CA) 2025-08-28 US disclosed
US-20250122207-A1 AP2 ASSOCIATED KINASE 1 INHIBITORS AND USES THEREOF SATELLOS BIOSCIENCE INC. (CA) 2025-04-17 US disclosed
WO-2025054448-A1 AP2 ASSOCIATED KINASE 1 INHIBITORS AND USES THEREOF SATELLOS BIOSCIENCE INC. (CA) 2025-03-13 WO disclosed
CN-113773335-B Compound serving as protein kinase inhibitor and preparation method and application thereof 成都海博为药业有限公司 2024-12-03 CN disclosed
CN-117412970-A Solid form of fluorine-containing macrocyclic structure compound, preparation method and application 成都倍特药业股份有限公司 2024-01-16 CN disclosed
CN-114073704-B Use of fluorine-containing heterocyclic derivative with macrocyclic structure 赛诺哈勃药业(成都)有限公司 2023-08-11 CN disclosed
CN-113336774-B Substituted chiral diaryl macrocyclic compounds as TRK inhibitors 江南大学 2023-05-23 CN disclosed
US-20230044722-A1 FLUORINE-CONTAINING HETEROCYCLIC DERIVATIVES WITH MACROCYCLIC STRUCTURE AND USE THEREOF SCINNOHUB PHARMACEUTICAL CO., LTD. (CN) 2023-02-09 US disclosed
WO-2022218276-A1 SOLID FORM OF FLUORINE-CONTAINING MACROCYCLIC STRUCTURE COMPOUND, PREPARATION METHOD, AND APPLICATION 成都倍特药业股份有限公司 2022-10-20 WO disclosed
CN-112110938-B Compound as protein kinase inhibitor and preparation method and application thereof 成都海博为药业有限公司 2021-11-09 CN disclosed
CN-113336774-A Substituted chiral diaryl macrocycles as TRK inhibitors 江南大学 2021-09-03 CN disclosed
WO-2021115401-A1 FLUORINE-CONTAINING HETEROCYCLIC DERIVATIVES WITH MACROCYCLIC STRUCTURE AND USE THEREOF 成都倍特药业股份有限公司 2021-06-17 WO disclosed
WO-2021115401-A1 FLUORINE-CONTAINING HETEROCYCLIC DERIVATIVES WITH MACROCYCLIC STRUCTURE AND USE THEREOF 成都倍特药业股份有限公司 2021-06-17 WO disclosed
US-20210087206-A1 MACROCYCLIC KINASE INHIBITORS AND THEIR USE TURNING POINT THERAPEUTICS INC (US) 2021-03-25 US disclosed
WO-2020257189-A1 MACROCYCLES FOR TREATING DISEASE Turning Point Therapeutics, Inc. (US) 2020-12-24 WO disclosed
CN-112110938-A Compound as protein kinase inhibitor and preparation method and application thereof 成都海博为药业有限公司 2020-12-22 CN disclosed
US-20200392160-A1 MACROCYCLIC COMPOUNDS FOR TREATING DISEASE TP THERAPEUTICS, INC. 2020-12-17 US disclosed
US-10745416-B2 Macrocyclic compounds for treating disease Turning Point Therapeutics, Inc. (US) 2020-08-18 US disclosed
US-20200190110-A1 MACROCYCLIC COMPOUNDS FOR TREATING DISEASE Turning Point Therapeutics, Inc. (US) 2020-06-18 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 (7 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-20250122207-A1 AP2 ASSOCIATED KINASE 1 INHIBITORS AND USES THEREOF AAK1, CAMKK1, AP2A1 KDM4E 3245/4885ALDH1A1 3638/4885HSD17B10 2313/4885
US-20200392160-A1 MACROCYCLIC COMPOUNDS FOR TREATING DISEASE VHL, DLD, PC KDM4E 3114/4885ALDH1A1 1658/4885HSD17B10 1019/4885
US-20200190110-A1 MACROCYCLIC COMPOUNDS FOR TREATING DISEASE VHL, DLD, PC KDM4E 3114/4885ALDH1A1 1658/4885HSD17B10 1019/4885
US-20230044722-A1 FLUORINE-CONTAINING HETEROCYCLIC DERIVATIVES WITH MACROCYCLIC STRUCTURE AND USE THEREOF FRK, BRAF, ERBB3 KDM4E 2301/4885ALDH1A1 4290/4885HSD17B10 3043/4885
US-10745416-B2 Macrocyclic compounds for treating disease VHL, DLD, PC KDM4E 3114/4885ALDH1A1 1658/4885HSD17B10 1019/4885
US-20210087206-A1 MACROCYCLIC KINASE INHIBITORS AND THEIR USE MAP3K20, LCK, MAP3K1 KDM4E 1234/4885ALDH1A1 4479/4885HSD17B10 3836/4885
US-20250270222-A1 AP2 ASSOCIATED KINASE 1 INHIBITORS AND USES THEREOF AAK1, AP2A1, CSNK1A1 KDM4E 2966/4885ALDH1A1 3210/4885HSD17B10 1620/4885

“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.