SCHEMBL3943579

SCHEMBL3943579

CCOC(=O)CC(=O)c1cccc(C)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.54
CYP1A2 P05177 1/20 0.53
GRM5 P41594 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
TP53 P04637 2/20 0.42
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NLRP3 Q96P20 2/20 0.41
MAPK1 P28482 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
SCHEMBL2915799 0.84 P2RX7 (0.51) P2RX7CYP1A2GRM5MEN1KMT2A
SCHEMBL5752974 0.84 CYP1A2 (0.50) CYP1A2MEN1KMT2AMGAMGAA
SCHEMBL18593230 0.84 CYP1A2 (0.50) P2RX7CYP1A2MEN1KMT2AMGAM
SCHEMBL1545927 0.84 CYP1A2 (0.63) CYP1A2GRM5MEN1KMT2AMGAM
SCHEMBL5751063 0.84 CYP1A2 (0.50) P2RX7CYP1A2MEN1KMT2AMGAM
SCHEMBL24141795 0.84 CYP1A2 (0.50) CYP1A2GRM5MEN1KMT2AMGAM
SCHEMBL15661105 0.83 CYP1A2 (0.49) CYP1A2GRM5MEN1KMT2AMGAM
SCHEMBL20028746 0.81 P2RX7 (0.55) P2RX7CYP1A2GRM5KMT2AMAPT
SCHEMBL1460111 0.80 KMT2A (0.57) MEN1KMT2AMGAMGAAMAPT
SCHEMBL19806454 0.80 P2RX7 (0.57) P2RX7CYP1A2GRM5MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250215017-A1 TGF-ß INHIBITOR COMPOUND AND USE THEROF MEDINNO PHARMACEUTICAL TECHNOLOGY (ZHUHAI) CO., LTD. (CN) 2025-07-03 US disclosed
US-20250179094-A1 TGF-B INHIBITOR COMPOUND AND USE THEREOF MEDINNO PHARMACEUTICAL TECHNOLOGY (ZHUHAI) CO., LTD. (CN) 2025-06-05 US disclosed
EP-4556478-A1 TGF-BETA INHIBITOR COMPOUND AND USE THEREOF Medinno Pharmaceutical Technology (Zhuhai) Co., Ltd. (CN) 2025-05-21 EP disclosed
EP-4556477-A1 TGF-BETA INHIBITOR COMPOUND AND USE THEREOF Medinno Pharmaceutical Technology (Zhuhai) Co., Ltd. (CN) 2025-05-21 EP disclosed
CN-117534686-A TGF-beta inhibitor compounds and uses thereof 河南迈英诺医药科技有限公司 2024-02-09 CN disclosed
CN-117534675-A TGF-beta inhibitor compounds and uses thereof 河南迈英诺医药科技有限公司 2024-02-09 CN disclosed
CN-113620956-B Transforming growth factor receptor antagonist, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-06-13 CN disclosed
WO-2022076905-A1 ALK5 INHIBITORS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2022-04-14 WO disclosed
WO-2022076905-A1 ALK5 INHIBITORS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2022-04-14 WO disclosed
US-11236112-B2 Crystal form and salt form of TGF-βRI inhibitor and preparation method therefor GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-02-01 US disclosed
US-20070155722-A1 Fused pyrazole derivatives as tgf-beta signal transduction inhibitors for the treatment of fibrosis and neoplasms ELI LILLY AND COMPANY (US) 2007-07-05 US disclosed
US-20070155722-A1 Fused pyrazole derivatives as tgf-beta signal transduction inhibitors for the treatment of fibrosis and neoplasms ELI LILLY AND COMPANY (US) 2007-07-05 US disclosed
EP-1723146-A1 FUSED PYRAZOLE DERIVATIVES AS TGF-BETA SIGNAL TRANSDUCTION INHIBITORS FOR THE TREATMENT OF FIBROSIS AND NEOPLASMS ELI LILLY AND COMPANY (US) 2006-11-22 EP disclosed
WO-2006052568-A2 TGF-BETA INHIBITORS ELI LILLY AND COMPANY (US) 2006-05-18 WO disclosed
US-20060058295-A1 Novel compounds as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-03-16 US disclosed
WO-2005092894-A1 FUSED PYRAZOLE DERIVATIVES AS TGF-BETA SIGNAL TRANSDUCTION INHIBITORS FOR THE TREATMENT OF FIBROSIS AND NEOPLASMS ELI LILLY AND COMPANY (US) 2005-10-06 WO disclosed
EP-1567528-A1 MIXED LINEAGE KINASE MODULATORS ELI LILLY AND COMPANY (US) 2005-08-31 EP disclosed
EP-1567527-A1 CONDENSED PYRAZOLO DERIVATIVES ELI LILLY AND COMPANY (US) 2005-08-31 EP disclosed
WO-2004050659-A1 NOVEL COMPOUNDS AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2004-06-17 WO disclosed
WO-2004048383-A1 MIXED LINEAGE KINASE MODULATORS ELI LILLY AND COMPANY (US) 2004-06-10 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 (5 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-20250179094-A1 TGF-B INHIBITOR COMPOUND AND USE THEREOF TGFB1, TGFB2, TGFBR1 P2RX7 3502/4885CYP1A2 2051/4885GRM5 3478/4885
US-20060058295-A1 Novel compounds as pharmaceutical agents TGFB1, TGFB2, TGFBR1 P2RX7 2979/4885CYP1A2 3740/4885GRM5 3565/4885
US-20070155722-A1 Fused pyrazole derivatives as tgf-beta signal transduction inhibitors for the treatment of fibrosis and neoplasms SMAD3, TGFBR1, TGFBR2 P2RX7 2870/4885CYP1A2 2583/4885GRM5 3371/4885
US-11236112-B2 Crystal form and salt form of TGF-βRI inhibitor and preparation method therefor TGFBR1, TGFBR2, TGFB1 P2RX7 3791/4885CYP1A2 4691/4885GRM5 2500/4885
US-20250215017-A1 TGF-ß INHIBITOR COMPOUND AND USE THEROF TGFB1, TGFB2, TGFBR2 P2RX7 3750/4885CYP1A2 3248/4885GRM5 2587/4885

“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.