SCHEMBL24422153

SCHEMBL24422153

C=C1CCC2C(C)(C)CCC[C@]2(C)C1/C=C/C(C)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 1.00
PTPN2 P17706 2/20 1.00
RPS6KA5 O75582 3/20 0.53
MAPKAPK2 P49137 3/20 0.53
PNLIP P16233 3/20 0.47
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP19A1 P11511 2/20 0.39
TRPA1 O75762 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
TRPV3 Q8NET8 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
UGT2B7 P16662 2/20 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
SCHEMBL30288170 0.90 PTPN1 (0.81) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL15588778 0.86 PTPN1 (0.76) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL16622822 0.86 PTPN1 (0.76) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL25396294 0.80 PTPN2 (0.67) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL25394431 0.80 PTPN2 (0.67) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL6783502 0.80 PTPN2 (0.67) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL25395895 0.80 PTPN2 (0.67) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL6783507 0.80 PTPN2 (0.67) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL25435120 0.79 PTPN2 (0.64) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP
SCHEMBL25433754 0.79 PTPN2 (0.64) PTPN1PTPN2RPS6KA5MAPKAPK2PNLIP

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-20220143124-A1 SYNERGISTIC HERBAL COMPOSITIONS FOR PREVENTION, TREATMENT OR CONTROL OF PAIN AND/OR CARTILAGE REGENERATION LAILA NUTRACEUTICALS (IN) 2022-05-12 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-20220143124-A1 SYNERGISTIC HERBAL COMPOSITIONS FOR PREVENTION, TREATMENT OR CONTROL OF PAIN AND/OR CARTILAGE REGENERATION TNF, COL2A1, ALPI PTPN1 3693/4885PTPN2 4249/4885RPS6KA5 421/4885

“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.