SCHEMBL22609099

SCHEMBL22609099

Clc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccncc1-2

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.45
AKR1A1 P14550 1/20 0.41
AKR1B1 P15121 1/20 0.41
CYP11B2 P19099 4/20 0.39
CYP11B1 P15538 2/20 0.39
F2 P00734 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
S100A4 P26447 1/20 0.35

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
SCHEMBL29398526 1.00 PDK2 (0.45) PDK2AKR1A1AKR1B1CYP11B2CYP11B1
SCHEMBL30322811 0.85 MAOA (0.47) PDK2CYP11B2KDM4ESMN1; SMN2MAOA
SCHEMBL19009209 0.85 MAOA (0.47) PDK2CYP11B2KDM4ESMN1; SMN2MAOA
SCHEMBL19147675 0.85 PDK2 (0.58) PDK2AKR1A1AKR1B1KDM4ESMN1; SMN2
SCHEMBL19009212 0.85 MAOA (0.47) PDK2CYP11B2KDM4ESMN1; SMN2MAOA
SCHEMBL17816711 0.83 PDK2 (0.56) PDK2AKR1A1AKR1B1KDM4ESMN1; SMN2
SCHEMBL31617854 0.82 PDK2 (0.43) PDK2AKR1A1AKR1B1CYP11B2CYP11B1
SCHEMBL20687315 0.80 PDK2 (0.57) PDK2AKR1A1AKR1B1KDM4ESMN1; SMN2
SCHEMBL20323359 0.80 CYP11B2 (0.41) PDK2AKR1A1AKR1B1CYP11B2CYP11B1
SCHEMBL22609095 0.79 PDK2 (0.45) PDK2AKR1A1AKR1B1F2

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-20220231234-A1 Compounds comprising a hetero-fluorene group NOVALED GMBH (DE) 2022-07-21 US disclosed
CN-113853370-A Compounds containing heterofluorene groups 诺瓦尔德股份有限公司 2021-12-28 CN disclosed
WO-2020221570-A1 COMPOUNDS COMPRISING A HETERO-FLUORENE GROUP NOVALED GMBH (DE) 2020-11-05 WO disclosed
EP-3733649-A1 HETERO-FLUORENE DERIVATIVES AND THEIR USE IN ELECTRONIC DEVICES Novaled GmbH (DE) 2020-11-04 EP disclosed
EP-3733649-A1 HETERO-FLUORENE DERIVATIVES AND THEIR USE IN ELECTRONIC DEVICES Novaled GmbH (DE) 2020-11-04 EP 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-20220231234-A1 Compounds comprising a hetero-fluorene group AFF2, AFF1, AFF4 PDK2 3893/4885AKR1A1 3960/4885AKR1B1 3848/4885

“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.