SCHEMBL23679028

SCHEMBL23679028

C=CCCCCCN(CCCCCCC)CCCCCCC

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.73
ALDH1A1 P00352 1/20 0.56
DNM1 Q05193 3/20 0.42
FAAH O00519 3/20 0.37
TRPV1 Q8NER1 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
SCHEMBL22157388 0.95 TSHR (0.65) TSHRALDH1A1DNM1FAAH
SCHEMBL22157379 0.95 TSHR (0.65) TSHRALDH1A1DNM1FAAH
SCHEMBL17398951 0.95 TSHR (0.65) TSHRALDH1A1DNM1
SCHEMBL7783171 0.95 TSHR (0.73) TSHRALDH1A1DNM1FAAHTRPV1
SCHEMBL18701402 0.95 TSHR (0.65) TSHRALDH1A1DNM1
SCHEMBL22157441 0.93 TSHR (0.62) TSHRALDH1A1DNM1FAAH
SCHEMBL15951725 0.93 TSHR (0.61) TSHRALDH1A1DNM1
SCHEMBL22157404 0.93 TSHR (0.61) TSHRALDH1A1DNM1FAAH
SCHEMBL18780475 0.91 TSHR (0.60) TSHRALDH1A1DNM1
SCHEMBL22157536 0.91 TSHR (0.60) TSHRALDH1A1DNM1FAAH

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-12037357-B2 Compounds for activating invariant natural killer T-cells and methods of use in eliminating inflammatory senescent cells DECIDUOUS THERAPEUTICS, INC. (US) 2024-07-16 US disclosed
US-20240025936-A1 COMPOUNDS FOR ACTIVATING INVARIANT NATURAL KILLER T-CELLS AND METHODS OF USE IN ELIMINATING INFLAMMATORY SENESCENT CELLS DECIDUOUS THERAPEUTICS, INC. (US) 2024-01-25 US disclosed
EP-3854303-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING BIO-ELECTRODE Shin-Etsu Chemical Co., Ltd. (JP) 2021-07-28 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 (2 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-12037357-B2 Compounds for activating invariant natural killer T-cells and methods of use in eliminating inflammatory senescent cells IL2, IL4, PBK TSHR 3328/4885ALDH1A1 1785/4885DNM1 3675/4885
US-20240025936-A1 COMPOUNDS FOR ACTIVATING INVARIANT NATURAL KILLER T-CELLS AND METHODS OF USE IN ELIMINATING INFLAMMATORY SENESCENT CELLS IL2, PBK, IL4 TSHR 3553/4885ALDH1A1 1217/4885DNM1 3826/4885

“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.