SCHEMBL3191157

SCHEMBL3191157

COc1ccc(Nc2nccc(Nc3ccc(F)c(Cl)c3)n2)cc1OCCCN1CCN(C)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.58
▸ CSF1R P07333 2/20 0.57
▸ IGF1R P08069 1/20 0.56
▸ EGFR P00533 11/20 0.55
▸ EHMT2 Q96KQ7 1/20 0.53
▸ EHMT1 Q9H9B1 1/20 0.53
▸ KDR P35968 3/20 0.52
▸ AXL P30530 3/20 0.51
▸ ERBB2 P04626 3/20 0.51
▸ LCK P06239 2/20 0.51
▸ SRC P12931 2/20 0.51
▸ MAPK14 Q16539 2/20 0.51
▸ CIT O14578 1/20 0.51
▸ GAK O14976 1/20 0.51
▸ EPHB6 O15197 1/20 0.51
▸ ABCC4 O15439 1/20 0.51
▸ DAPK3 O43293 1/20 0.51
▸ RIPK2 O43353 1/20 0.51
▸ NR1I2 O75469 1/20 0.51
▸ RPS6KA4 O75676 1/20 0.51

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
SCHEMBL19476341 0.81 IGF1R (0.66) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL3203410 0.80 IGF1R (0.55) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL19476861 0.79 EHMT2 (0.74) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL19462482 0.79 EHMT2 (0.77) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL30367701 0.79 EHMT2 (0.77) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL19476364 0.79 EHMT2 (0.71) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL13485390 0.78 IGF1R (0.53) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL19476383 0.78 EHMT2 (0.76) BRD4IGF1REGFREHMT2EHMT1
SCHEMBL28540768 0.78 EGFR (0.54) BRD4CSF1REGFRAXLERBB2
SCHEMBL30213684 0.78 EGFR (0.54) BRD4CSF1REGFRAXLERBB2

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-20100029675-A1 Pyrimidine-2, 4-diamine JAK2 Kinase inhibiting anti-inflammation use TOLERO PHARMACEUTICALS, INC. 2010-02-04 — — US disclosed
US-20100029675-A1 Pyrimidine-2, 4-diamine JAK2 Kinase inhibiting anti-inflammation use TOLERO PHARMACEUTICALS, INC. 2010-02-04 — — US disclosed
US-20100029675-A1 Pyrimidine-2, 4-diamine JAK2 Kinase inhibiting anti-inflammation use TOLERO PHARMACEUTICALS, INC. 2010-02-04 — — US disclosed
WO-2010011349-A2 PYRIMIDINE-2,4-DIAMINE JAK2 KINASE INHIBITING ANTI-INFLAMMATION USE SUPERGEN, INC. (US) 2010-01-28 — — WO disclosed
WO-2010011349-A2 PYRIMIDINE-2,4-DIAMINE JAK2 KINASE INHIBITING ANTI-INFLAMMATION USE SUPERGEN, INC. (US) 2010-01-28 — — WO disclosed
EP-2121634-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SuperGen, Inc. (US) 2009-11-25 — — EP disclosed
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 — — US disclosed
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 — — US disclosed
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 — — US disclosed
WO-2008106635-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 — — WO disclosed
WO-2008106635-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS SUPERGEN, INC. (US) 2008-09-04 — — 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-20100029675-A1 Pyrimidine-2, 4-diamine JAK2 Kinase inhibiting anti-inflammation use JAK2, JAK1, IRAK4 BRD4 2018/4885CSF1R 820/4885IGF1R 1339/4885
US-20080214558-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AND THEIR USE AS JAK2 KINASE INHIBITORS JAK2, JAK1, JAK3 BRD4 251/4885CSF1R 1305/4885IGF1R 1726/4885

“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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