SCHEMBL21776145

SCHEMBL21776145

CCCC(CCC)C(N)CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.42
LMNA P02545 2/20 0.35
OPRM1 P35372 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP2D6 P10635 2/20 0.30
SPHK1 Q9NYA1 1/20 0.30
GMNN O75496 1/20 0.30
POLB P06746 1/20 0.30
THPO P40225 1/20 0.30
MTOR P42345 1/20 0.30
BLM P54132 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
CETP P11597 1/20 0.30
HTT P42858 1/20 0.30
UBE2N P61088 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
SCHEMBL24668130 0.91 METAP1 (0.41) METAP1LMNAOPRM1
SCHEMBL23862861 0.87 OPRM1 (0.48) METAP1LMNAOPRM1ALDH1A1TDP1
SCHEMBL5349656 0.84 METAP1 (0.44) METAP1LMNAOPRM1CYP2D6SPHK1
Ammonia Solution, Strong SCHEMBL1302715 0.83 OPRM1 (0.44) LMNAOPRM1CYP2D6SPHK1GMNN
SCHEMBL5371282 0.82 ALDH1A1 (0.44) LMNAOPRM1ALDH1A1TDP1CYP2D6
SCHEMBL23072529 0.82 METAP1 (0.35) METAP1
SCHEMBL22179713 0.82 TSHR (0.38) METAP1LMNAOPRM1ALDH1A1TDP1
SCHEMBL16649023 0.80 OPRM1 (0.52) LMNAOPRM1ALDH1A1TDP1CYP2D6
SCHEMBL16111959 0.79 METAP1 (0.41) METAP1OPRM1ALDH1A1TDP1
SCHEMBL22609036 0.79

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-11239114-B2 Semiconductor device with reduced contact resistance and methods of forming the same TAIWAN SEMICONDUCTOR MANUFACTURING CO., LTD. (TW) 2022-02-01 US disclosed
US-20210082756-A1 Semiconductor Device with Reduced Contact Resistance and Methods of Forming the Same TAIWAN SEMICONDUCTOR MANUFACTURING CO., LTD. (TW) 2021-03-18 US disclosed
US-20200062760-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2020-02-27 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-20200062760-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPRCAP, PTPRJ, PTPRC METAP1 1452/4885LMNA 4793/4885OPRM1 4779/4885

“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.