SCHEMBL22528276

SCHEMBL22528276

c1ccc2c3c([nH]c2c1)CN(CC1CO1)CC3

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.58
▸ HTR1A P08908 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.55
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ ATM Q13315 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ GRIN2B Q13224 1/20 0.54
▸ RCE1 Q9Y256 1/20 0.54
▸ DRD1 P21728 1/20 0.52
▸ DRD5 P21918 1/20 0.52

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
SCHEMBL24122147 1.00 SIGMAR1 (0.58) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL22549343 0.90 ACHE (0.62) SIGMAR1KDM4E
SCHEMBL17517486 0.82 SIGMAR1 (0.68) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL7783645 0.80 DRD1 (0.62) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL6369610 0.79 HTR1A (0.71) SIGMAR1HTR1AKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL10396301 0.79 DRD1 (0.61) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL1415530 0.77 HTR1A (0.81) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL10397222 0.76 SIGMAR1 (0.61) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL30443405 0.76 SIGMAR1 (0.61) SIGMAR1HTR1AKDM4EMEN1KMT2A
SCHEMBL14656766 0.76 SIGMAR1 (0.61) SIGMAR1HTR1AKDM4EMEN1KMT2A

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-110621675-B Tricyclic compounds useful for the treatment of proliferative diseases 阿古诺治疗有限公司 2023-09-19 — — CN disclosed
EP-3596073-B1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS. ARGONAUT THERAPEUTICS LTD (GB) 2022-05-11 — — EP disclosed
EP-3596073-B1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS. ARGONAUT THERAPEUTICS LTD (GB) 2022-05-11 — — EP disclosed
WO-2021254493-A1 CYCLIC COMPOUND HAVING ANTI-TUMOR ACTIVITY AND USE THEREOF 上海翊石医药科技有限公司 2021-12-23 — — WO disclosed
US-20200325132-A1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS Argonaut Therapeutics Limited (GB) 2020-10-15 — — US disclosed
US-20200325132-A1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS Argonaut Therapeutics Limited (GB) 2020-10-15 — — 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 (1 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-20200325132-A1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS PRMT5, HDAC5, CDK15 SIGMAR1 3868/4885HTR1A 3202/4885KDM4E 243/4885

“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.

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