SCHEMBL8349013

SCHEMBL8349013

C=C(C)/C=C\c1ccccc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ RAB9A P51151 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ APOBEC3A P31941 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ NR1H2 P55055 1/20 0.39
▸ NR1H3 Q13133 1/20 0.39
▸ GMNN O75496 1/20 0.37
▸ PMP22 Q01453 1/20 0.37

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
SCHEMBL2961735 1.00 TSHR (0.45) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL8661727 0.87 MAPT (0.47) ALDH1A1RAB9AKDM4ELMNAMAPT
SCHEMBL8859640 0.83 ALDH1A1 (0.45) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL13816225 0.82 TSHR (0.43) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL17682919 0.82 TSHR (0.43) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL16507826 0.81 CD44 (0.41) TSHRALDH1A1KDM4ELMNAMAPT
SCHEMBL12809932 0.81 LMNA (0.44) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL20373431 0.80 TSHR (0.42) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL3437259 0.80 TSHR (0.42) TSHRALDH1A1RAB9AKDM4EAPOBEC3A
SCHEMBL7899013 0.79 MAPT (0.66) TSHRALDH1A1RAB9AKDM4ELMNA

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-20230192691-A1 HETEROCYCLIC COMPOUNDS AS BTK INHIBITORS BEIJING INNOCARE PHARMA TECH CO LTD (CN) 2023-06-22 — — US disclosed
WO-2017049409-A1 COMPOSITIONS FOR PROMOTING READTHROUGH OF PREMATURE TERMINATION CODONS, AND METHODS OF USING THE SAME THE CENTRE FOR DRUG RESEARCH AND DEVELOPMENT (CA) 2017-03-30 — — WO disclosed
WO-2003030886-A2 ALLYLAMIDES USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC (US) 2003-04-17 — — 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-20230192691-A1 HETEROCYCLIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LYN TSHR 1901/4885ALDH1A1 3975/4885RAB9A 1035/4885

“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.

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