SCHEMBL12205477

SCHEMBL12205477

CC(C)N1CCCC(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.43
TRIM24 O15164 2/20 0.39
TRIM33 Q9UPN9 2/20 0.39
ALDH1A1 P00352 3/20 0.38
PIK3CD O00329 1/20 0.36
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
BRD4 O60885 1/20 0.34
BRD2 P25440 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
DAO P14920 1/20 0.31
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAOB P27338 2/20 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
SCHEMBL4790280 0.92 CHRNA7 (0.38) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
SCHEMBL190568 0.91 CHRNA7 (0.50) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
Iodide SCHEMBL6583609 0.88 CHRNA7 (0.48) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
Hydrochloric Acid SCHEMBL3732680 0.88 CHRNA7 (0.48) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
Bromide SCHEMBL3731956 0.88 CHRNA7 (0.48) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
SCHEMBL1698543 0.82 ALDH1A1 (0.39) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
Acetone SCHEMBL7727826 0.82 CHRNA7 (0.48) CHRNA7ALDH1A1GAAL3MBTL1THRB
Hydrochloric Acid SCHEMBL3741338 0.80 ALDH1A1 (0.38) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
Bromide SCHEMBL3734670 0.80 ALDH1A1 (0.38) CHRNA7TRIM24TRIM33ALDH1A1PIK3CD
SCHEMBL11670185 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
WO-2023230190-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-11-30 WO disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2023-11-23 US disclosed
WO-2023154766-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
WO-2023109944-A1 TLR MODULATOR AND USE THEREOF 映恩生物制药(苏州)有限公司 2023-06-22 WO disclosed
WO-2022256459-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2022-12-08 WO disclosed
US-20220348577-A1 CXCR4 Receptor Antagonists PROXIMAGEN LLC (US) 2022-11-03 US disclosed
EP-2627649-B1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2015-04-08 EP disclosed
US-20130289020-A1 CXCR4 Receptor Antagonists PROXIMAGEN LIMITED (GB) 2013-10-31 US disclosed
EP-2627649-A1 CXCR4 RECEPTOR ANTAGONISTS Proximagen Limited (GB) 2013-08-21 EP disclosed
WO-2012049277-A1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-19 WO disclosed
WO-2012049277-A1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-19 WO disclosed
US-8034940-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-11 US disclosed
US-8034940-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-11 US disclosed
US-20110230472-A1 RING-FUSED AZOLE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2011-09-22 US disclosed
US-20090075995-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2009-03-19 US disclosed
US-20090075995-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2009-03-19 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 (7 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-20220348577-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 CHRNA7 387/4885TRIM24 4193/4885TRIM33 4657/4885
US-20110230472-A1 RING-FUSED AZOLE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY PIK3R5, PIK3R4, PIK3R1 CHRNA7 4610/4885TRIM24 1190/4885TRIM33 473/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS CHRNA7 320/4885TRIM24 3829/4885TRIM33 4010/4885
US-20130289020-A1 CXCR4 Receptor Antagonists CXCR4, ACKR3, CXCR1 CHRNA7 470/4885TRIM24 2833/4885TRIM33 4121/4885
US-20090075995-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF NFKB2, NFRKB, NFKB1 CHRNA7 2248/4885TRIM24 3591/4885TRIM33 3880/4885
US-20230374042-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS CHRNA7 4728/4885TRIM24 2159/4885TRIM33 2369/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS CHRNA7 4728/4885TRIM24 2159/4885TRIM33 2369/4885

“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.