SCHEMBL24701664

SCHEMBL24701664

Cc1cccc2c1SC(C)(C)C2(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PDK2 Q15119 1/20 0.33
TRPA1 O75762 2/20 0.32
CD44 P16070 1/20 0.32
ATM Q13315 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
TSHR P16473 1/20 0.31
ACHE P22303 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CNR1 P21554 1/20 0.30
HTT P42858 1/20 0.30
GPR35 Q9HC97 1/20 0.30
GPR55 Q9Y2T6 1/20 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
SCHEMBL24701670 0.78
SCHEMBL24858844 0.70 CA1 (0.39) CA1CA2CA7CA9ALDH1A1
SCHEMBL14703070 0.67 PDK2 (0.34) ALDH1A1PDK2CYP1A2ACHEKDM4E
SCHEMBL20646227 0.63 MEN1 (0.41) CA1CA2CA7CA9PDK2
SCHEMBL28349034 0.62 PDK2 (0.36) CA1CA2CA7CA9ALDH1A1
SCHEMBL8658664 0.62 PDK2 (0.36) CA1CA2CA7CA9ALDH1A1
SCHEMBL9245632 0.62 CYP2A6 (0.36) CA1CA2CA7CA9ALDH1A1
SCHEMBL28613659 0.62 HTR7 (0.49) CA1CA2CA7CA9ALDH1A1
SCHEMBL24701901 0.61 CYP2A6 (0.35) CA1CA2CA7CA9ALDH1A1
SCHEMBL22973341 0.60 PDK2 (0.36) CA1CA2CA7CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220393115-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-12-08 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 (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-20220393115-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF LEF1, L1CAM, PIEZO1 CA1 1363/4885CA2 2303/4885CA7 1745/4885

“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.