SCHEMBL20022933

SCHEMBL20022933

COCCNC(=O)CCCC(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.59
HPGD P15428 6/20 0.50
CNR1 P21554 3/20 0.50
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 2/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 4/20 0.44
CNR2 P34972 1/20 0.43
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL21947703 0.91 TSHR (0.73) TSHRHPGDCNR1LMNAPKM
SCHEMBL17620529 0.89 TSHR (0.53) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL12834880 0.86 TSHR (0.59) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL23729303 0.85 TSHR (0.64) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL12934640 0.85 TSHR (0.69) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL25480646 0.84 TSHR (0.54) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL18707765 0.84 HPGD (0.49) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL24935539 0.83 TSHR (0.51) TSHRHPGDCNR1LMNAPKM
SCHEMBL18707764 0.83 HPGD (0.48) TSHRHPGDCNR1HTTSMN1; SMN2
SCHEMBL25532038 0.83 TSHR (0.47) TSHRHPGDCNR1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827744-B2 Bottlebrush copolymers and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-11-28 US disclosed
US-20180094099-A1 BOTTLEBRUSH COPOLYMERS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-04-05 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 (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-20180094099-A1 BOTTLEBRUSH COPOLYMERS AND USES THEREOF TRIB1, TRIB2, ABCB11 TSHR 777/4885HPGD 773/4885CNR1 636/4885
US-11827744-B2 Bottlebrush copolymers and uses thereof TRIB1, TRIB2, ABCB11 TSHR 777/4885HPGD 773/4885CNR1 636/4885

“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.