SCHEMBL18237542

SCHEMBL18237542

CC(C)C1CCNc2cccnc21

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.34
▸ AR P10275 1/20 0.33
▸ GRM4 Q14833 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ IDH1 O75874 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CHRNB2 P17787 1/20 0.31
▸ CHRNA4 P43681 1/20 0.31
▸ HTR2A P28223 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ HTR2B P41595 1/20 0.30

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
SCHEMBL24402677 0.84 CHRNB2 (0.33) GSK3BTP53CHRNB2CHRNA4
SCHEMBL31669380 0.77 GSK3B (0.33) GSK3B
SCHEMBL19153952 0.77 GSK3B (0.40) GSK3BADORA3ADORA2AADORA1CHRNB2
SCHEMBL18886131 0.74 AR (0.40) ARHTR2C
SCHEMBL24835401 0.74 IDH1 (0.32) IDH1
SCHEMBL22966378 0.74 — —
SCHEMBL24090522 0.74 AR (0.40) ARHTR2C
SCHEMBL13059131 0.74 AR (0.40) ARHTR2C
SCHEMBL18259028 0.74 KDM1A (0.34) GSK3BADORA3ADORA2AADORA1CHRNB2
SCHEMBL22966389 0.73 F2 (0.36) ARGRM4IDH1HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 — — US disclosed
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 — — US disclosed
US-11739072-B2 Heteroaryl compounds and their use MINORYX THERAPEUTICS S.L. (ES) 2023-08-29 — — US disclosed
US-11174242-B2 Heteroaryl compounds and their use MINORYX THERAPEUTICS S.L. (ES) 2021-11-16 — — US disclosed
WO-2016183359-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. (US) 2016-11-17 — — 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 (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-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 GSK3B 163/4885AR 2205/4885GRM4 1880/4885
US-11174242-B2 Heteroaryl compounds and their use GBA1, GBA2, GAA GSK3B 1377/4885AR 3839/4885GRM4 4196/4885
US-11739072-B2 Heteroaryl compounds and their use GBA1, GBA2, GAA GSK3B 1377/4885AR 3839/4885GRM4 4196/4885

“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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