SCHEMBL4355423

SCHEMBL4355423

CCCCCCCOC(Cl)C(C)CC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.44
LPAR1 Q92633 4/20 0.34
LPAR3 Q9UBY5 4/20 0.34
LPAR2 Q9HBW0 1/20 0.34
THRB P10828 2/20 0.33
SPHK1 Q9NYA1 1/20 0.33
TSHR P16473 1/20 0.33
USP2 O75604 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 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
SCHEMBL4368508 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4359404 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4357538 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4352980 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4361798 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4358199 1.00 DNM1 (0.44) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4355412 0.98 DNM1 (0.41) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4354990 0.91 DNM1 (0.33) DNM1TSHR
SCHEMBL4359813 0.83 DNM1 (0.47) DNM1LPAR1LPAR3LPAR2THRB
SCHEMBL4362678 0.83 DNM1 (0.47) DNM1LPAR1LPAR3LPAR2THRB

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-20090035702-A1 PROCESS FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2009-02-05 US disclosed
US-20060177763-A1 Method for producing compound having acid-labile group KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2006-08-10 US disclosed
EP-1661918-A1 METHOD FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP Kyowa Hakko Chemical Co., Ltd. (JP) 2006-05-31 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-20090035702-A1 PROCESS FOR PRODUCING COMPOUND HAVING ACID-LABILE GROUP AGL, HACL2, ARL1 DNM1 4461/4885LPAR1 421/4885LPAR3 564/4885

“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.