SCHEMBL2522162

SCHEMBL2522162

O=C1CCC=C1COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
KIF11 P52732 1/20 0.40
TK1 P04183 8/20 0.39
ELANE P08246 1/20 0.37
TK2 O00142 6/20 0.35
DUT P33316 1/20 0.34
SLC6A1 P30531 1/20 0.34
GSTP1 P09211 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
SCHEMBL21807989 0.71 CYP2C9 (0.37) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL21808098 0.71 CYP2C9 (0.37) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL28791230 0.68 KIF11 (0.47) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL2207349 0.67 KIF11 (0.39) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL1092597 0.67 KIF11 (0.54) CYP2C9TSHRCYP2C19KIF11TK1
SCHEMBL21807990 0.65 ELANE (0.36) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL9865376 0.64 KIF11 (0.56) CYP2C9ALOX15TSHRCYP2C19KIF11
Ammonia Solution, Strong SCHEMBL7560279 0.64 KIF11 (0.50) CYP2C9TSHRCYP2C19KIF11TK1
SCHEMBL11275984 0.64 KIF11 (0.74) CYP2C9ALOX15TSHRCYP2C19KIF11
SCHEMBL22091459 0.64 KIF11 (0.39) CYP2C9ALOX15TSHRCYP2C19KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113544122-A Cyclopentyl nucleoside analogs as antiviral agents 詹森生物制药有限公司 2021-10-22 CN disclosed
EP-3894395-A2 CYCLOPENTYL NUCLEOSIDE ANALOGS AS ANTI-VIRALS Janssen BioPharma, Inc. (US) 2021-10-20 EP disclosed
WO-2020121123-A2 CYCLOPENTYL NUCLEOSIDE ANALOGS AS ANTI-VIRALS Janssen Biopharma, Inc. (US) 2020-06-18 WO disclosed
US-8569490-B2 Intermediate and process for preparing entecavir using same HANMI SCIENCE CO., LTD (KR) 2013-10-29 US disclosed
EP-2382217-B1 NOVEL INTERMEDIATE AND PROCESS FOR PREPARING ENTECAVIR USING SAME HANMI SCIENCE CO LTD (KR) 2013-10-23 EP disclosed
EP-2382217-A2 NOVEL INTERMEDIATE AND PROCESS FOR PREPARING ENTECAVIR USING SAME Hanmi Holdings Co., Ltd. (KR) 2011-11-02 EP disclosed
US-20110251387-A1 NOVEL INTERMEDIATE AND PROCESS FOR PREPARING ENTECAVIR USING SAME HANMI HOLDINGS CO., LTD. (KR) 2011-10-13 US disclosed
WO-2010074534-A2 NOVEL INTERMEDIATE AND PROCESS FOR PREPARING ENTECAVIR USING SAME HANMI PHARM. CO., LTD. (KR) 2010-07-01 WO 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-20110251387-A1 NOVEL INTERMEDIATE AND PROCESS FOR PREPARING ENTECAVIR USING SAME ENTPD5, ENTPD1, SAMHD1 CYP2C9 482/4885ALOX15 2297/4885TSHR 4597/4885

“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.