SCHEMBL9990446

SCHEMBL9990446

Cc1cc(Cl)ccc1N(C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHKA P35790 7/20 0.53
LTC4S Q16873 1/20 0.46
CSF1R P07333 1/20 0.45
CHKB Q9Y259 2/20 0.45
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
GSK3B P49841 1/20 0.39
CRHR1 P34998 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.38
ALDH1A1 P00352 1/20 0.36
FSCN1 Q16658 1/20 0.36

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
SCHEMBL28043798 0.83 CHKA (0.40) CHKALTC4SCSF1RKDM4EMAPT
SCHEMBL13509013 0.81 MEN1 (0.40) CHKALMNAMAPTKMT2A
SCHEMBL3524418 0.80 GAA (0.59) CHKACSF1RCHKBKDM4ELMNA
SCHEMBL28000888 0.79 CHKA (0.50) CHKACSF1RCHKBKDM4ELMNA
SCHEMBL29120709 0.78 TSHR (0.40) CHKALTC4SKDM4ELMNAMAPT
SCHEMBL3261175 0.76 CHKA (0.51) CHKACSF1RCHKBKDM4ELMNA
SCHEMBL6423587 0.76 CHKA (0.51) CHKACSF1RCHKBKDM4ELMNA
SCHEMBL20210149 0.76 RXRA (0.40) CHKACSF1RGAAKMT2A
SCHEMBL11105220 0.76 ALDH1A1 (0.49) CHKALTC4SCSF1RCHKBKDM4E
SCHEMBL8233668 0.76 KMT2A (0.57) KDM4EGAAKMT2AGPBAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613504-A1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS Johnson Matthey Public Limited Company (GB) 2020-02-26 EP disclosed
EP-3613504-A1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS Johnson Matthey Public Limited Company (GB) 2020-02-26 EP disclosed
EP-2585216-B1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS JOHNSON MATTHEY PLC (GB) 2019-11-20 EP disclosed
EP-2585216-B1 PI-ALLYLPALLADIUM AND PI-ALLYLNICKEL COMPLEXES FOR USE AS CATALYSTS IN CARBON-CARBON AND CARBON-NITROGEN COUPLING REACTIONS JOHNSON MATTHEY PLC (GB) 2019-11-20 EP disclosed
US-20190016742-A1 Complexes JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-01-17 US disclosed
US-10167305-B2 Allyl complexes for use in coupling reactions JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-01-01 US disclosed
US-10167305-B2 Allyl complexes for use in coupling reactions JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2019-01-01 US disclosed
US-20130165660-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2013-06-27 US disclosed
US-20130165660-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2013-06-27 US disclosed
US-20130165660-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2013-06-27 US disclosed
EP-2585216-A1 COMPLEXES Johnson Matthey PLC (GB) 2013-05-01 EP disclosed
WO-2011161451-A1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2011-12-29 WO disclosed
WO-2011161451-A1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2011-12-29 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 (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-10167305-B2 Allyl complexes for use in coupling reactions AP3M1, AP1M1, C9 CHKA 3356/4885LTC4S 1532/4885CSF1R 1126/4885
US-20190016742-A1 Complexes C5, C1S, C9 CHKA 3990/4885LTC4S 1873/4885CSF1R 556/4885

“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.