SCHEMBL427055

SCHEMBL427055

Cc1cc(C(=O)N2CCN(C)CC2)cc(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.64
CYP3A4 P08684 3/20 0.54
USP2 O75604 2/20 0.54
TSHR P16473 2/20 0.54
CYP2C19 P33261 1/20 0.54
EPHX2 P34913 2/20 0.53
HPGD P15428 3/20 0.51
ALOX15 P16050 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HRH4 Q9H3N8 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP2C9 P11712 2/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
KCNH2 Q12809 1/20 0.46
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
RHOC P08134 1/20 0.46
RHOA P61586 1/20 0.46

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
SCHEMBL13503815 0.84 HPGD (0.70) TSHRCYP2C19HPGDALOX15MEN1
SCHEMBL1265003 0.84 HIF1A (0.63) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL15219384 0.84 HIF1A (0.52) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL12959478 0.84 HIF1A (0.52) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL430127 0.84 HIF1A (0.52) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL428206 0.83 HIF1A (0.49) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL12959479 0.81 HIF1A (0.49) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL30080693 0.80 L3MBTL1 (0.75) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL4935101 0.80 L3MBTL1 (0.75) HIF1ACYP3A4USP2TSHRCYP2C19
SCHEMBL13503960 0.79 POLB (0.74) HIF1ATSHREPHX2HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-03-15 US disclosed
US-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-03-15 US disclosed
US-7687643-B2 Process for preparing 3,3-dimethylindolines AMGEN INC. (US) 2010-03-30 US disclosed
US-7687643-B2 Process for preparing 3,3-dimethylindolines AMGEN INC. (US) 2010-03-30 US disclosed
US-7514564-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2009-04-07 US disclosed
US-7514564-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2009-04-07 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 (1 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-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AADAC, NAT1, PIGO HIF1A 147/4885CYP3A4 237/4885USP2 3404/4885

“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.