SCHEMBL23977007

SCHEMBL23977007

N[C@@]1(CO)CCCc2cc(F)ccc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.44
CYP17A1 P05093 3/20 0.40
CYP3A4 P08684 3/20 0.40
CYP11B2 P19099 3/20 0.40
CYP11B1 P15538 2/20 0.40
DPP4 P27487 2/20 0.35
SLC6A3 Q01959 2/20 0.34
SLC6A4 P31645 1/20 0.34
RAD52 P43351 1/20 0.34
SRD5A1 P18405 1/20 0.34
PITRM1 Q5JRX3 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
HDAC4 P56524 1/20 0.32

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
SCHEMBL28970246 1.00 KDM1A (0.44) KDM1ACYP17A1CYP3A4CYP11B2CYP11B1
SCHEMBL28970240 0.81 BACE1 (0.39) KDM1ARAD52
SCHEMBL28970245 0.81 BACE1 (0.39) KDM1ARAD52
SCHEMBL23976448 0.81 BACE1 (0.39) KDM1ARAD52
SCHEMBL30060666 0.81 BACE1 (0.39) KDM1ARAD52
SCHEMBL4044850 0.78 KDM1A (0.57) KDM1ACYP3A4SLC6A3SLC6A4
SCHEMBL23976461 0.74 KDM4E (0.56) KDM1ACYP17A1CYP3A4CYP11B2CYP11B1
SCHEMBL23961494 0.71 KDM1A (0.41) KDM1ASRD5A1
SCHEMBL23291576 0.71 KDM1A (0.41) KDM1ASRD5A1
SCHEMBL23976820 0.71 KDM1A (0.41) KDM1ASRD5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220401422-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF HIF2-alpha AND THEIR METHODS OF USE NOVARTIS AG (CH) 2022-12-22 US disclosed
CN-115485275-A Compounds and compositions that inhibit HIF 2-alpha activity and methods of use thereof 诺华股份有限公司 2022-12-16 CN disclosed
WO-2021217508-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF HIF2α AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-11-04 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 (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-20220401422-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF HIF2-alpha AND THEIR METHODS OF USE HIF1AN, HIF1A, EGLN2 KDM1A 1025/4885CYP17A1 338/4885CYP3A4 3032/4885

“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.