SCHEMBL7538752

SCHEMBL7538752

ClCc1cnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.36
KCNA3 P22001 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.34
TSHR P16473 2/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CYP19A1 P11511 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
MAPT P10636 1/20 0.31
AURKA O14965 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
SCHEMBL3152998 0.83 TSHR (0.39) KCNN4KCNA3L3MBTL1TSHRCYP11B1
SCHEMBL23532019 0.83 TP53 (0.39) KCNN4KCNA3L3MBTL1CYP11B1CYP11B2
SCHEMBL5363164 0.83 TRPA1 (0.39) KCNN4KCNA3L3MBTL1TSHRCYP11B1
SCHEMBL7544520 0.80 TDP1 (0.42) KCNN4KCNA3CYP11B1CYP11B2
SCHEMBL13539077 0.79 KCNN4 (0.31) KCNN4KCNA3CYP11B1CYP11B2
SCHEMBL3152490 0.79 L3MBTL1 (0.32) KCNN4KCNA3L3MBTL1CYP11B1CYP11B2
SCHEMBL7544535 0.79 FLT3 (0.33) KCNN4KCNA3CYP11B1CYP11B2MAPT
SCHEMBL10814483 0.79 IDO1 (0.44) KCNN4KCNA3
SCHEMBL1195324 0.79 AKR1B1 (0.44) RECQLTSHRMAPT
SCHEMBL27247249 0.79 MAPT (0.43) KCNN4KCNA3CYP11B1CYP11B2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6468995-B1 ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-10-22 US disclosed
EP-0667868-B1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO (JP) 2002-05-15 EP disclosed
US-20010056089-A1 Novel crystal of cephalosporin compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-12-27 US disclosed
US-20010007903-A1 NOVEL CRYSTAL OF CEPHALOSPORIN COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-07-12 US disclosed
EP-0780393-A1 NOVEL CRYSTAL OF CEPHALOSPORIN COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed
CN-1116425-A New cephem compounds FUJISAWA PHARMACEUTICAL CO (JP) 1996-02-07 CN disclosed
WO-1995007283-A1 NEW CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-03-16 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 (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-20010056089-A1 Novel crystal of cephalosporin compound CEP170, CXXC4, DAO KCNN4 707/4885KCNA3 2614/4885L3MBTL1 4138/4885
US-20010007903-A1 NOVEL CRYSTAL OF CEPHALOSPORIN COMPOUND CEP170, CXXC4, DAO KCNN4 707/4885KCNA3 2614/4885L3MBTL1 4138/4885

“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.