SCHEMBL2872180

SCHEMBL2872180

CC(C)Oc1ccc(Cc2ccc(C(=O)Cl)s2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
KDM4A O75164 1/20 0.41
MAPT P10636 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 1/20 0.40
GAA P10253 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PARP10 Q53GL7 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SLC5A2 P31639 1/20 0.39
MAPK1 P28482 1/20 0.39
TP53 P04637 1/20 0.39
ALDH1A3 P47895 1/20 0.38
ACACB O00763 3/20 0.38

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
SCHEMBL2868563 0.83 POLB (0.44) POLBKDM4AMAPTKDM4CKMT2A
SCHEMBL2864616 0.82 POLB (0.46) POLBMAPTGAACYP2C19L3MBTL1
SCHEMBL2864886 0.80 KDM4E (0.49) CYP1A2CYP2D6LMNAKDM4ETP53
SCHEMBL2871061 0.79 SRD5A2 (0.51) TP53
SCHEMBL2869145 0.77 MAPT (0.46) POLBMAPTKMT2AL3MBTL1NPC1
SCHEMBL2863521 0.77 MEN1 (0.40) POLBMAPTKMT2APARP10KDM4E
SCHEMBL2863556 0.76 TP53 (0.48) CYP1A2CYP2D6KDM4ETP53
SCHEMBL2867918 0.76 TP53 (0.48) CYP1A2CYP2D6KDM4ETP53
SCHEMBL2865230 0.76 NR4A2 (0.52) KMT2ACYP1A2CYP2C19LMNAPARP10
SCHEMBL2865052 0.76 SRD5A2 (0.44) ACACB

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-7691898-B2 Phosphonic acid derivatives and the treating agents of diseases related hyperphosphatemia KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2010-04-06 US disclosed
US-20080119441-A1 Phosphonic Acid Derivatives and the Treating Agents of Diseases Related Hyperphosphatemia KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
EP-1813620-A1 PHOSPHONIC ACID DERIVATIVE AND THERAPEUTIC AGENT FOR DISEASE IN WHICH HIGH PHOSPHATE LEVEL IN BLOOD PARTICIPATES Kotobuki Pharmaceutical Co., Ltd. (JP) 2007-08-01 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-20080119441-A1 Phosphonic Acid Derivatives and the Treating Agents of Diseases Related Hyperphosphatemia NR0B1, NR0B2, PTH1R POLB 2456/4885KDM4A 4555/4885MAPT 4759/4885

“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.