SCHEMBL6103736

SCHEMBL6103736

O=C(O)c1ccnnc1NCc1ccc(F)cc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 2/20 0.76
▸ P4HTM Q9NXG6 1/20 0.48
▸ PPARA Q07869 3/20 0.47
▸ STING1 Q86WV6 1/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ KDM4E B2RXH2 4/20 0.43
▸ KDM4C Q9H3R0 2/20 0.43
▸ AURKA O14965 1/20 0.43
▸ RPS6KB1 P23443 1/20 0.43
▸ CISD1 Q9NZ45 1/20 0.43
▸ DHODH Q02127 1/20 0.43
▸ KDM6B O15054 1/20 0.43
▸ KDM4A O75164 1/20 0.43
▸ KDM4D Q6B0I6 1/20 0.43
▸ ASPH Q12797 3/20 0.42
▸ KDM8 Q8N371 3/20 0.42

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
SCHEMBL15528862 0.87 KDM5B (1.00) KDM5BKMT2AKDM4EKDM4CAURKA
SCHEMBL1715643 0.80 DHODH (0.63) KDM5BP4HTMKMT2ACYP1A2CYP2C19
SCHEMBL6104425 0.78 CISD1 (0.49) KDM5BP4HTMPPARASTING1KMT2A
SCHEMBL22609297 0.77 P4HTM (0.48) KDM5BP4HTMPPARASTING1KMT2A
SCHEMBL18049776 0.75 PDPK1 (0.49) KDM5BP4HTMKMT2AMAPTKDM4E
SCHEMBL15738084 0.75 KDM5B (0.42) KDM5BP4HTMKMT2ACYP1A2CYP2C19
SCHEMBL29582097 0.74 KDM4C (0.76) KDM5BKDM4EKDM4CKDM6BKDM4A
SCHEMBL15818320 0.74 KDM4C (0.76) KDM5BKDM4EKDM4CKDM6BKDM4A
SCHEMBL870110 0.74 P4HTM (0.55) P4HTMPPARASTING1KMT2ACYP1A2
SCHEMBL3146401 0.74 KDM5B (0.62) KDM5BKMT2AKDM4EKDM4CAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101868-B2 Substituted arylamine derivatives and methods of use AMGEN INC. (US) 2006-09-05 — — US claimed
EP-1583744-A2 SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2005-10-12 — — EP claimed
US-20040204437-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2004-10-14 — — US claimed
WO-2004007457-A2 SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2004-01-22 — — WO claimed
US-20030134836-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2003-07-17 — — US claimed
US-7101868-B2 Substituted arylamine derivatives and methods of use AMGEN INC. (US) 2006-09-05 — — US disclosed
EP-1583744-A2 SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2005-10-12 — — EP disclosed
US-20050153960-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2005-07-14 — — US disclosed
US-20040204437-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2004-10-14 — — US disclosed
WO-2004007457-A2 SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2004-01-22 — — WO disclosed
US-20030134836-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2003-07-17 — — 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 (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-20050153960-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM5B 459/4885P4HTM 114/4885PPARA 487/4885
US-20040204437-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM5B 459/4885P4HTM 114/4885PPARA 487/4885
US-20030134836-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM5B 459/4885P4HTM 114/4885PPARA 487/4885

“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.

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