SCHEMBL22411264

SCHEMBL22411264

Cc1ccc(-c2cc(C3CCCC3)c(N)c(N)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.46
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ACVR2A P27037 1/20 0.40
TGFBR2 P37173 1/20 0.40
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 5/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAD51 Q06609 1/20 0.38
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HSD17B10 Q99714 1/20 0.37
AGTR1 P30556 1/20 0.37

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
SCHEMBL30873839 1.00 ADK (0.46) ADKADORA2AADORA1NPC1RAB9A
SCHEMBL30873848 0.85 DYRK1A (0.48) ADKADORA1NPC1RAB9AMEN1
SCHEMBL22411374 0.85 DYRK1A (0.48) ADKADORA1NPC1RAB9AMEN1
SCHEMBL22411323 0.84 ADK (0.42) ADKMEN1KMT2AALDH1A1CYP2C19
SCHEMBL30873836 0.84 ADK (0.42) ADKMEN1KMT2AALDH1A1CYP2C19
SCHEMBL22411289 0.78 ADK (0.39) ADKCAMKK2
SCHEMBL30873880 0.78 ADK (0.39) ADKCAMKK2
SCHEMBL30873906 0.78 ADK (0.39) ADKADORA2AADORA1NPC1RAB9A
SCHEMBL22411369 0.76 PPARA (0.45) ADORA2AMEN1KMT2AKDM4EALDH1A1
SCHEMBL30873847 0.76 PPARA (0.45) ADORA2AMEN1KMT2AKDM4EALDH1A1

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
CN-118290350-A Heteroaryl and bisheteroaryl derivatives for the treatment of iron death-related disorders 协同医药发展有限公司 2024-07-05 CN disclosed
CN-113631535-B Heteroaryl and bisheteroaryl derivatives for the treatment of iron death-related disorders 协同医药发展有限公司 2024-04-12 CN disclosed
US-20230172940-A1 METHODS OF EXTENDING LIFESPAN BY ADMINISTERING FERROPTOSIS INHIBITORS COLLABORATIVE MEDICINAL DEVELOPMENT, LLC (US) 2023-06-08 US disclosed
US-20220144826-A1 Heteroaromatic and Heterobicyclic Aromatic Derivatives for the Treatment of Ferroptosis-Related Disorders COLLABORATIVE MEDICINAL DEVELOPMENT, LLC (US) 2022-05-12 US disclosed
EP-3938340-A1 HETEROAROMATIC AND HETEROBICYCLIC AROMATIC DERIVATIVES FOR THE TREATMENT OF FERROPTOSIS-RELATED DISORDERS Collaborative Medicinal Development, LLC (US) 2022-01-19 EP disclosed
CN-113631535-A Heteroaryl and bis-heterocyclic aryl derivatives for the treatment of disorders associated with iron death 协同医药发展有限公司 2021-11-09 CN disclosed
WO-2020185738-A1 HETEROAROMATIC AND HETEROBICYCLIC AROMATIC DERIVATIVES FOR THE TREATMENT OF FERROPTOSIS-RELATED DISORDERS COLLABORATIVE MEDICINAL DEVELOPMENT, LLC (US) 2020-09-17 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 (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-20230172940-A1 METHODS OF EXTENDING LIFESPAN BY ADMINISTERING FERROPTOSIS INHIBITORS GPX4, GPX1, AIFM2 ADK 1651/4885ADORA2A 3132/4885ADORA1 3568/4885
US-20220144826-A1 Heteroaromatic and Heterobicyclic Aromatic Derivatives for the Treatment of Ferroptosis-Related Disorders AIFM2, FECH, SLC40A1 ADK 2734/4885ADORA2A 1111/4885ADORA1 1559/4885

“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.