SCHEMBL17209129

SCHEMBL17209129

CC(=O)Nc1ccc(F)cc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
CHRM3 P20309 11/20 0.53
CHRM2 P08172 7/20 0.53
CHRM1 P11229 7/20 0.53
HDAC1 Q13547 2/20 0.50
KDM4E B2RXH2 2/20 0.50
APOBEC3A P31941 1/20 0.50
GFER P55789 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
HDAC3 O15379 1/20 0.49
HDAC2 Q92769 1/20 0.49
TOP2A P11388 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
GAA P10253 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HTT P42858 1/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL18415465 0.87 MAPT (0.56) MAPTCHRM3CHRM2CHRM1HDAC1
SCHEMBL3906763 0.87 MAPT (0.56) MAPTCHRM3CHRM2CHRM1HDAC1
SCHEMBL2479383 0.84 ADORA3 (0.53) MAPTTOP2ASMN1; SMN2GAANPC1
SCHEMBL1116494 0.84 CHRM3 (0.53) MAPTCHRM3CHRM2CHRM1KDM4E
SCHEMBL17805491 0.84 CHRM3 (0.61) MAPTCHRM3CHRM2CHRM1
SCHEMBL20194476 0.83 HDAC1 (0.66) MAPTHDAC1KDM4EAPOBEC3AGFER
SCHEMBL20194441 0.83 MAPT (0.56) MAPTCHRM3CHRM2CHRM1RAB9A
SCHEMBL11187279 0.82 HDAC7 (0.54) MAPTCHRM3HDAC1KDM4EAPOBEC3A
SCHEMBL17206261 0.82 KDM4E (0.55) MAPTHDAC1KDM4EAPOBEC3AGFER
SCHEMBL17206020 0.81 CHRM3 (0.52) MAPTCHRM3CHRM2CHRM1HDAC1

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-10246407-B2 Process for preparing biphenylamines from anilides by ruthenium catalysis BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-04-02 US disclosed
US-10246408-B2 Process for preparing biphenylamines from anilides by ruthenium catalysis BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-04-02 US disclosed
EP-3326715-A1 OXALIC ACID MONOAMIDE LIGAND, AND USES THEREOF IN COUPLING REACTION OF COPPER-CATALYZED ARYL HALOGEN SUBSTITUTE Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2018-05-30 EP disclosed
US-20170044094-A1 PROCESS FOR PREPARING BIPHENYLAMINES FROM ANILIDES BY RUTHENIUM CATALYSIS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-02-16 US disclosed
US-20170044094-A1 PROCESS FOR PREPARING BIPHENYLAMINES FROM ANILIDES BY RUTHENIUM CATALYSIS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-02-16 US disclosed
EP-3009420-A1 Method for the production of biphenylamines from anilides using ruthenium catalysis Bayer CropScience AG (DE) 2016-04-20 EP disclosed
WO-2015162144-A1 METHOD FOR PRODUCING BIPHENYLAMINES FROM ANILIDES BY RUTHENIUM CATALYSIS BAYER CROPSCIENCE AG (DE) 2015-10-29 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 (3 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-10246407-B2 Process for preparing biphenylamines from anilides by ruthenium catalysis SBDS, AGPS, CYP2B6 MAPT 3447/4885CHRM3 2865/4885CHRM2 2183/4885
US-10246408-B2 Process for preparing biphenylamines from anilides by ruthenium catalysis SBDS, AGPS, CYP2B6 MAPT 3447/4885CHRM3 2865/4885CHRM2 2183/4885
US-20170044094-A1 PROCESS FOR PREPARING BIPHENYLAMINES FROM ANILIDES BY RUTHENIUM CATALYSIS SBDS, AGPS, CYP2B6 MAPT 3447/4885CHRM3 2865/4885CHRM2 2183/4885

“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.