SCHEMBL984171

SCHEMBL984171

CCCCC(C)c1ccccc1Oc1[c]cccc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATM Q13315 1/20 0.33
PPARG P37231 3/20 0.32
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
PPARA Q07869 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NISCH Q9Y2I1 1/20 0.30
TSHR P16473 1/20 0.30
HTR2A P28223 1/20 0.30
SLC6A4 P31645 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
SCHEMBL982118 0.91 KDM4E (0.32) KDM4EL3MBTL1ATMMEN1KMT2A
SCHEMBL983302 0.86 DHFR (0.34) PPARGTSHR
SCHEMBL980127 0.86 DHFR (0.34) PPARG
SCHEMBL983861 0.85 TSHR (0.44) KDM4EL3MBTL1ATMPPARAKMT2A
SCHEMBL982282 0.82 DHFR (0.33) L3MBTL1MEN1KMT2A
SCHEMBL982030 0.80 DHFR (0.32) L3MBTL1MEN1KMT2A
SCHEMBL983816 0.80 P2RX3 (0.42) L3MBTL1CYP1A2CYP2C9CYP2C19MEN1
SCHEMBL981915 0.79 L3MBTL1 (0.33) KDM4EL3MBTL1ATMNISCHTSHR
SCHEMBL5853299 0.79 LTA4H (0.46) KDM4EL3MBTL1ATMPPARGPTGES
SCHEMBL6683928 0.78 TSHR (0.43) KDM4EL3MBTL1PPARGALOX5PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
US-9233918-B2 Isocyanate production process ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-01-12 US disclosed
US-20110092731-A1 ISOCYANATE PRODUCTION PROCESS ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-04-21 US disclosed
EP-2275406-A1 PROCESS FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2011-01-19 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-20110092731-A1 ISOCYANATE PRODUCTION PROCESS CPS1, PHGDH, APEH KDM4E 1003/4885L3MBTL1 3460/4885ATM 2082/4885

“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.