SCHEMBL24316331

SCHEMBL24316331

OC1(c2cc3ccccc3cc2-c2cccc(Cl)c2)C2CC3CC(C2)CC1C3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.40
HSD11B1 P28845 3/20 0.40
ADORA1 P30542 3/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CXCR3 P49682 1/20 0.35
MIF P14174 1/20 0.34
ADORA2A P29274 1/20 0.34
CHEK1 O14757 1/20 0.34
SLC6A3 Q01959 1/20 0.34
TDP2 O95551 2/20 0.33
CTSD P07339 1/20 0.33
DHFR P00374 1/20 0.33
PGR P06401 1/20 0.33
CHRM1 P11229 1/20 0.33

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
SCHEMBL25038269 0.88 CYP2A6 (0.40) PDK2HSD11B1SLC6A3
SCHEMBL24316938 0.88 PDK2 (0.39) PDK2HSD11B1ADORA1KDM4ENPC1
SCHEMBL25054827 0.86 PDK2 (0.48) PDK2HSD11B1KDM4ENPC1ALDH1A1
SCHEMBL23606148 0.86 PDK2 (0.48) PDK2HSD11B1KDM4ENPC1ALDH1A1
SCHEMBL24316343 0.86 SLC6A3 (0.40) PDK2HSD11B1KDM4ENPC1ALDH1A1
SCHEMBL25035892 0.86 PDK2 (0.35) PDK2HSD11B1ADORA1SMN1; SMN2CXCR3
SCHEMBL24316404 0.86 KMT2A (0.37) PDK2HSD11B1KDM4ENPC1ALDH1A1
SCHEMBL24316388 0.81 CYP1A2 (0.40) PDK2HSD11B1ADORA1KDM4ENPC1
SCHEMBL25962010 0.81 HSD11B1 (0.39) PDK2HSD11B1ADORA1LMNATDP2
SCHEMBL24316340 0.80 CYP1A2 (0.37) PDK2HSD11B1KDM4ENPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11800792-B2 Organic compound with spirocyclic adamantane, and electronic element and electronic device using same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-10-24 US disclosed
US-11800792-B2 Organic compound with spirocyclic adamantane, and electronic element and electronic device using same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-10-24 US disclosed
US-11691952-B2 Nitrogen-containing compound, and electronic element and electronic device using same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-04 US disclosed
US-11691952-B2 Nitrogen-containing compound, and electronic element and electronic device using same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-04 US disclosed
US-20230200215-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230200215-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230052660-A1 NITROGEN-CONTAINING COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-02-16 US disclosed
WO-2022068292-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME 陕西莱特光电材料股份有限公司 2022-04-07 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 (4 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-11800792-B2 Organic compound with spirocyclic adamantane, and electronic element and electronic device using same OR51E2, SQLE, ODC1 PDK2 327/4885HSD11B1 588/4885ADORA1 444/4885
US-20230052660-A1 NITROGEN-CONTAINING COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME NOD1, NFE2L2, NOTCH1 PDK2 3491/4885HSD11B1 2932/4885ADORA1 3294/4885
US-20230200215-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME LEF1, OCIAD1, OR10J3 PDK2 705/4885HSD11B1 1933/4885ADORA1 3735/4885
US-11691952-B2 Nitrogen-containing compound, and electronic element and electronic device using same NOD1, NFE2L2, NOTCH1 PDK2 3491/4885HSD11B1 2932/4885ADORA1 3294/4885

“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.