SCHEMBL17378554

SCHEMBL17378554

Cn1c(C(F)(F)F)nc2cc(Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.44
PDE2A O00408 2/20 0.41
ACSS2 Q9NR19 2/20 0.41
HCRTR1 O43613 1/20 0.41
MAPT P10636 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
NUDT1 P36639 1/20 0.39
BACE1 P56817 1/20 0.39
AGPAT2 O15120 1/20 0.39
LMNA P02545 1/20 0.37
XBP1 P17861 1/20 0.37
PPARG P37231 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL17378563 0.87 RAB9A (0.45) KDM4EALDH1A1CYP1A2HPGDKMT2A
SCHEMBL14504050 0.85 KDM4E (0.46) KDM4EALDH1A1CYP1A2HPGDKMT2A
SCHEMBL16595230 0.82 KDM4E (0.42) KDM4EALDH1A1CYP1A2HPGDKMT2A
SCHEMBL10238327 0.81 MEN1 (0.47) KDM4ECYP1A2KMT2APDE2AACSS2
SCHEMBL26790445 0.80 MAPT (0.49) ALDH1A1HPGDKMT2APDE2AACSS2
SCHEMBL5419669 0.80 KDM4E (0.44) KDM4EALDH1A1HPGDKMT2AACSS2
SCHEMBL20799418 0.79 AGPAT2 (0.47) KDM4EALDH1A1CYP1A2HPGDKMT2A
SCHEMBL13057628 0.79 ACSS2 (0.43) KDM4ECYP1A2KMT2AACSS2
SCHEMBL17378608 0.78 FGFR1 (0.42) KMT2AACSS2HTTFGFR1MAPK14
SCHEMBL10239601 0.78 ACSS2 (0.63) KDM4EALDH1A1HPGDKMT2AACSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3162799-B1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-03-10 EP disclosed
EP-3162799-B1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2021-03-10 EP disclosed
US-10696640-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-06-30 US disclosed
US-10696640-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-06-30 US disclosed
US-20190233380-A1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-08-01 US disclosed
US-20190233380-A1 FLUOROALKYLATING AGENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-08-01 US disclosed
US-10308613-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-06-04 US disclosed
US-10308613-B2 Fluoroalkylating agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2019-06-04 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
US-20170197920-A1 FLUOROALKYLATING AGENT IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2017-07-13 US disclosed
EP-3162799-A1 FLUOROALKYLATING AGENT Ihara Chemical Industry Co., Ltd. (JP) 2017-05-03 EP disclosed
EP-3162799-A1 FLUOROALKYLATING AGENT Ihara Chemical Industry Co., Ltd. (JP) 2017-05-03 EP disclosed
WO-2015199109-A1 FLUOROALKYLATING AGENT イハラケミカル工業株式会社 2015-12-30 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 (4 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-10308613-B2 Fluoroalkylating agent AFF1, AFF4, AFF2 KDM4E 2539/4885ALDH1A1 2072/4885CYP1A2 540/4885
US-10696640-B2 Fluoroalkylating agent AFF1, AFF4, AFF2 KDM4E 2539/4885ALDH1A1 2072/4885CYP1A2 540/4885
US-20190233380-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 KDM4E 2539/4885ALDH1A1 2072/4885CYP1A2 540/4885
US-20170197920-A1 FLUOROALKYLATING AGENT AFF1, AFF4, AFF2 KDM4E 2539/4885ALDH1A1 2072/4885CYP1A2 540/4885

“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.