SCHEMBL5376783

SCHEMBL5376783

C=CCOC(C)CCCCCC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
FAAH O00519 5/20 0.38
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH4 P08319 1/20 0.37
ADH7 P40394 1/20 0.37
OPRM1 P35372 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
SPHK1 Q9NYA1 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
DNM1 Q05193 1/20 0.33

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
SCHEMBL11670947 1.00 TSHR (0.42) TSHRFAAHADH1BADH1CADH1A
SCHEMBL15442569 1.00 TSHR (0.42) TSHRFAAHADH1BADH1CADH1A
SCHEMBL11672964 1.00 TSHR (0.42) TSHRFAAHADH1BADH1CADH1A
SCHEMBL11671624 0.92 TSHR (0.37) TSHROPRM1ALDH1A1DNM1
SCHEMBL9448501 0.83
SCHEMBL9511261 0.82 MAPT (0.39) TSHRALDH1A1
SCHEMBL9511222 0.82 MAPT (0.39) TSHRALDH1A1
SCHEMBL25125852 0.82 TSHR (0.43) TSHRADH1BADH1CADH1AADH4
SCHEMBL16107215 0.82 TSHR (0.43) TSHRADH1BADH1CADH1AADH4
SCHEMBL454872 0.82 TSHR (0.43) TSHRADH1BADH1CADH1AADH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105385349-B Hydrophobic antifouling organopolysilazane coating of one kind and its preparation method and application 广州弘海化工科技有限公司 2018-08-31 CN disclosed
CN-105385349-A Hydrophobic and antifouling organic polysilazane coating, and preparation method and application thereof GUANGZHOU WINHIGH CHEMICAL TECH CO LTD 2016-03-09 CN disclosed
US-7304184-B2 Process for producing allyl-containing compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-04 US disclosed
US-20040171885-A1 Process for producing allyl-containing compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-02 US disclosed
EP-1452516-A2 Process for producing allyl-containing compounds Daicel Chemical Industries, Ltd. (JP) 2004-09-01 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 (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-20040171885-A1 Process for producing allyl-containing compounds SRD5A2, RPS4Y1, SULT1E1 TSHR 2424/4885FAAH 1308/4885ADH1B 610/4885

“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.