SCHEMBL19166199

SCHEMBL19166199

C[N+](C)([O-])CCCNC(=O)F

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.37
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EPHX1 P07099 2/20 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
SCHEMBL19169878 0.83 ACHE (0.43) KDM4EMAPK1HIF1AKMT2AMEN1
SCHEMBL16807333 0.81 KDM4E (0.56) LSSKDM4EMAPK1HIF1AKMT2A
SCHEMBL19170146 0.79 ALDH1A1 (0.61) LSSKDM4EKMT2AMEN1ALDH1A1
SCHEMBL19170330 0.76 KMT2A (0.36) KDM4EMAPK1HIF1AKMT2AMEN1
SCHEMBL5983411 0.75 ZDHHC20 (0.55) LSSMAPK1KMT2AATMALDH1A1
SCHEMBL19165102 0.75 BBOX1 (0.39) KDM4EMAPK1HIF1AKMT2AATM
SCHEMBL966796 0.75 KDM4E (0.34) LSSKDM4EMAPK1HIF1AKMT2A
SCHEMBL19170295 0.73
SCHEMBL19293675 0.72 KMT2A (0.34) KDM4EMAPK1HIF1AKMT2AMEN1
SCHEMBL422872 0.71 FAAH (0.60) LSSKDM4E

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
US-20170247265-A1 FILTER MEDIUM, METHOD FOR PRODUCING FILTER MEDIUM, WATER TREATMENT MODULE, AND WATER TREATMENT DEVICE MITSUBISHI MATERIALS CORPORATION (JP) 2017-08-31 US disclosed
US-20170210912-A1 HYDROPHILIC OIL REPELLENT AND PRODUCTION METHOD OF SAME, SURFACE COATING MATERIAL, COATING FILM, RESIN COMPOSITION, OIL-WATER SEPARATION FILTER MATERIAL, AND POROUS BODY MITSUBISHI MATERIALS ELECTRONIC CHEMICALS CO., LTD. (JP) 2017-07-27 US disclosed
US-20170210916-A1 SURFACE COATING MATERIAL, COATING FILM, AND HYDROPHILIC OIL REPELLENT MEMBER MITSUBISHI MATERIALS CORPORATION (JP) 2017-07-27 US disclosed
US-20170210643-A1 OIL-WATER SEPARATION APPARATUS AND DRAINAGE SYSTEM MITSUBISHI MATERIALS CORPORATION (JP) 2017-07-27 US 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-20170210643-A1 OIL-WATER SEPARATION APPARATUS AND DRAINAGE SYSTEM AQP1, AQP3, AQP4 LSS 166/4885KDM4E 4472/4885MAPK1 1552/4885
US-20170210912-A1 HYDROPHILIC OIL REPELLENT AND PRODUCTION METHOD OF SAME, SURFACE COATING MATERIAL, COATING FILM, RESIN COMPOSITION, OIL-WATER SEPARATION FILTER MATERIAL, AND POROUS BODY FABP4, FFAR1, FFAR2 LSS 1701/4885KDM4E 2754/4885MAPK1 3055/4885

“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.