SCHEMBL8347188

SCHEMBL8347188

Fc1ccc(Cl)cc1-c1ncc(C2CC2)c(Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.43
ACVR1B P36896 2/20 0.43
BMPR1A P36894 1/20 0.43
ACVRL1 P37023 1/20 0.43
ACVR1 Q04771 1/20 0.43
PLAT P00750 2/20 0.35
OPRL1 P41146 3/20 0.35
PRKD3 O94806 1/20 0.35
PRKD1 Q15139 1/20 0.35
PRKD2 Q9BZL6 1/20 0.35
DHODH Q02127 1/20 0.34
IDO1 P14902 1/20 0.34
AXL P30530 1/20 0.33
AURKA O14965 1/20 0.33
SGK1 O00141 1/20 0.33
SLC22A1 O15245 1/20 0.33
ABCB11 O95342 1/20 0.33
CYP3A4 P08684 1/20 0.33
DRD3 P35462 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL3824178 0.94 TGFBR1 (0.40) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL8347929 0.94 TGFBR1 (0.40) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL8346113 0.76 PIM1 (0.38) TGFBR1PRKD3PRKD1PRKD2IDO1
SCHEMBL16879582 0.75 TGFBR1 (0.57) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL8345869 0.74 TGFBR1 (0.46) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL3838556 0.74 TGFBR1 (0.47) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL30499257 0.73 TGFBR1 (0.53) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL28996713 0.73 TGFBR1 (0.53) TGFBR1ACVR1BBMPR1AACVRL1ACVR1
SCHEMBL3838487 0.72 PDE4D (0.36) TGFBR1PRKD3PRKD1PRKD2AURKA
SCHEMBL8344312 0.72 MAPT (0.46) TGFBR1ACVR1BACVRL1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9987277-B2 Carboxamide 4-[(4-pyridyl)amino] pryimidines for the treatment of hepatitis C JANSSEN SCIENCES IRELAND UC (IE) 2018-06-05 US disclosed
US-9987277-B2 Carboxamide 4-[(4-pyridyl)amino] pryimidines for the treatment of hepatitis C JANSSEN SCIENCES IRELAND UC (IE) 2018-06-05 US disclosed
US-20090247523-A1 CARBOXAMIDE 4-[(4-PYRIDYL)AMINO]PYRIMIDINES USEFUL AS HCV INHIBITORS JANSSEN SCIENCES IRELAND UC (IE) 2009-10-01 US disclosed
US-20090247523-A1 CARBOXAMIDE 4-[(4-PYRIDYL)AMINO]PYRIMIDINES USEFUL AS HCV INHIBITORS JANSSEN SCIENCES IRELAND UC (IE) 2009-10-01 US disclosed
WO-2008040778-A2 CARBOXAMIDE 4-[(4-PYRIDYL)AMINO] PYRIMIDINES FOR THE TREATMENT OF HEPATITIS C TIBOTEC PHARMACEUTICALS LTD. (IE) 2008-04-10 WO disclosed
WO-2004024159-A1 INHIBITORS OF TFGβ SCIOS INC. (US) 2004-03-25 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 (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-20090247523-A1 CARBOXAMIDE 4-[(4-PYRIDYL)AMINO]PYRIMIDINES USEFUL AS HCV INHIBITORS HAVCR2, EIF2AK2, MAVS TGFBR1 3765/4885ACVR1B 3981/4885BMPR1A 3796/4885

“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.