SCHEMBL29600604

SCHEMBL29600604

c1cnc2nnccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MMP2 P08253 2/20 0.42
TSHR P16473 2/20 0.42
CYP3A4 P08684 2/20 0.42
HTT P42858 2/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
HSP90AA1 P07900 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
MMP9 P14780 1/20 0.42
ALOX15 P16050 1/20 0.42
NFKB1 P19838 1/20 0.42
MMP8 P22894 1/20 0.42
CCR1 P32246 1/20 0.42
THPO P40225 1/20 0.42

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
SCHEMBL31254127 1.00 ALDH1A1 (0.44) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL12406 1.00 ALDH1A1 (0.44) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29047204 0.82 ALDH1A1 (0.33) ALDH1A1KDM4ELMNAMEN1KMT2A
Benzofuran SCHEMBL29153281 0.81 KDM4E (0.36) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL28304525 0.79 CCR1 (0.55) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL8193 0.79 CCR1 (0.55) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL29354893 0.79 CCR1 (0.55) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL30323275 0.79
Ammonia Solution, Strong SCHEMBL2732606 0.76 CCR1 (0.52) ALDH1A1KDM4ELMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL16337846 0.76 CCR1 (0.52) ALDH1A1KDM4ELMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957218-A Piperidine amine compound containing fused ring pyrimidine and preparation method and application thereof 沈阳中化农药化工研发有限公司 2022-08-30 CN claimed
US-20250250282-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS Prism BioLab Co., Ltd. (JP) 2025-08-07 US disclosed
EP-4508052-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2025-02-19 EP disclosed
CN-119013278-A Novel seven-membered ring fused compounds 株式会社棱镜生物实验室 2024-11-22 CN disclosed
US-20240309006-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2024-09-19 US disclosed
CN-110740996-B Covalent small molecule DCN1 inhibitors and methods of treatment using the same 密执安大学评议会 2024-01-09 CN disclosed
EP-4281456-A1 NOVEL BICYCLIC COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2023-11-29 EP disclosed
US-20230374034-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-11-23 US disclosed
WO-2023200017-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS Prism BioLab Co., Ltd. (JP) 2023-10-19 WO disclosed
EP-4225760-A1 NOVEL BICYCLIC COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2023-08-16 EP disclosed
WO-2023140369-A1 PHOSPHORIC ACID DERIVATIVES Prism BioLab Co., Ltd. (JP) 2023-07-27 WO disclosed
CN-116348119-A Novel bicyclic compounds 株式会社棱镜生物实验室 2023-06-27 CN disclosed
EP-4182317-A1 NOVEL HETEROCYCLIC COMPOUNDS PRISM BioLab Co., Ltd. (JP) 2023-05-24 EP disclosed
CN-116018345-A Novel heterocyclic compounds 株式会社棱镜生物实验室 2023-04-25 CN disclosed
WO-2022158610-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2022-07-28 WO disclosed
WO-2022075486-A1 NOVEL BICYCLIC COMPOUNDS Prism BioLab Co., Ltd. (JP) 2022-04-14 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 (3 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-20230374034-A1 NOVEL BICYCLIC COMPOUNDS NOTCH1, NOTCH2, HES1 ALDH1A1 1622/4885KDM4E 1654/4885LMNA 2319/4885
US-20240309006-A1 NOVEL BICYCLIC COMPOUNDS NOTCH1, NOTCH2, HES1 ALDH1A1 1423/4885KDM4E 1617/4885LMNA 2371/4885
US-20250250282-A1 NOVEL SEVEN-MEMBERED RING-FUSED COMPOUNDS NOTCH1, NOTCH2, NOTCH4 ALDH1A1 2685/4885KDM4E 2182/4885LMNA 3551/4885

“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.