SCHEMBL22408944

SCHEMBL22408944

CCNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ VCAM1 P19320 1/20 0.46
▸ GLA P06280 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ TBXA2R P21731 3/20 0.42
▸ PDE2A O00408 1/20 0.42
▸ PDE5A O76074 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ PDE4A P27815 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ PDE1B Q01064 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ PDE4B Q07343 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ PDE7A Q13946 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
SCHEMBL11451900 0.84 S1PR4 (0.53) ALDH1A1VCAM1SMN1; SMN2MEN1KMT2A
SCHEMBL29539120 0.81 TBXA2R (0.46) ALDH1A1SMN1; SMN2MEN1KMT2ATBXA2R
SCHEMBL20789180 0.81 TBXA2R (0.46) ALDH1A1SMN1; SMN2MEN1KMT2ATBXA2R
SCHEMBL29539082 0.78 TBXA2R (0.43) ALDH1A1TBXA2RPDE2APDE5ACYP3A4
SCHEMBL20789306 0.78 TBXA2R (0.43) ALDH1A1TBXA2RPDE2APDE5ACYP3A4
SCHEMBL3810591 0.78 PTPRC (0.47) ALDH1A1SMN1; SMN2MEN1KMT2APDE2A
SCHEMBL29538993 0.78 PTPRC (0.47) ALDH1A1SMN1; SMN2MEN1KMT2APDE2A
SCHEMBL667271 0.76 CA1 (0.65) ALDH1A1VCAM1MEN1KMT2ACA1
SCHEMBL19552612 0.76 CA2 (0.55) ALDH1A1PDE2APDE5ACYP3A4ALOX15
SCHEMBL29404344 0.76 ALDH1A1 (0.56) ALDH1A1VCAM1GLASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360120-A1 RAD51 INHIBITORS CYTEIR THERAPEUTICS, INC. 2024-10-31 — — US disclosed
EP-3938358-B1 RAD51 INHIBITORS CYTEIR THERAPEUTICS INC (US) 2024-10-02 — — EP disclosed
CN-114072390-B RAD51 inhibitors 赛泰尔治疗公司 2024-06-11 — — CN disclosed
US-11932636-B2 RAD51 inhibitors CYTEIR THERAPEUTICS, INC. (US) 2024-03-19 — — US disclosed
US-20220259198-A1 RAD51 INHIBITORS CYTEIR THERAPEUTICS, INC. 2022-08-18 — — US disclosed
CN-114072390-A RAD51 inhibitors 赛泰尔治疗公司 2022-02-18 — — CN disclosed
US-11247988-B2 RAD51 inhibitors CYTEIR THERAPEUTICS, INC. (US) 2022-02-15 — — US disclosed
US-11247988-B2 RAD51 inhibitors CYTEIR THERAPEUTICS, INC. (US) 2022-02-15 — — US disclosed
EP-3938358-A1 RAD51 INHIBITORS Cyteir Therapeutics, Inc. (US) 2022-01-19 — — EP disclosed
WO-2020186006-A1 RAD51 INHIBITORS CYTEIR THERAPEUTICS, INC. (US) 2020-09-17 — — WO disclosed
US-20200291014-A1 RAD51 INHIBITORS CYTEIR THERAPEUTICS, INC. 2020-09-17 — — US disclosed
US-20200291014-A1 RAD51 INHIBITORS CYTEIR THERAPEUTICS, INC. 2020-09-17 — — 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 (5 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-11247988-B2 RAD51 inhibitors RAD51, MRE11, RAD54L ALDH1A1 4493/4885VCAM1 2449/4885GLA 3415/4885
US-20220259198-A1 RAD51 INHIBITORS RAD51, MRE11, RAD54L ALDH1A1 4493/4885VCAM1 2449/4885GLA 3415/4885
US-20200291014-A1 RAD51 INHIBITORS RAD51, MRE11, RAD54L ALDH1A1 4493/4885VCAM1 2449/4885GLA 3415/4885
US-20240360120-A1 RAD51 INHIBITORS RAD51, MRE11, RAD54L ALDH1A1 4493/4885VCAM1 2449/4885GLA 3415/4885
US-11932636-B2 RAD51 inhibitors RAD51, MRE11, RAD54L ALDH1A1 4493/4885VCAM1 2449/4885GLA 3415/4885

“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.

Send feedback