SCHEMBL3169179

SCHEMBL3169179

Cc1c(C)n(CCCN2CCOCC2)c2ncnc(Cl)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR2F2 P24468 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TP53 P04637 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 1/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ TLR7 Q9NYK1 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL17406919 0.94 NR2F2 (0.53) NR2F2MEN1KMT2ATP53MAPT
SCHEMBL3165717 0.85 LMNA (0.42) KMT2ATP53MAPTMAPK1LMNA
SCHEMBL3151879 0.83 KMT2A (0.55) MEN1KMT2ATP53MAPTMAPK1
SCHEMBL17406874 0.79 LMNA (0.41) MEN1KMT2AMAPK1LMNAHSD17B10
SCHEMBL17406849 0.75 MEN1 (0.47) NR2F2MEN1KMT2AMAPTMAPK1
SCHEMBL19731316 0.73 ADK (0.40) NR2F2TP53MAPTMAPK1HSD17B10
SCHEMBL17406924 0.72 KMT2A (0.58) NR2F2MEN1KMT2AMAPK1HSD17B10
SCHEMBL19731314 0.68 ADK (0.40) NR2F2MEN1KMT2AMAPK1LMNA
SCHEMBL868512 0.68 ADK (0.39) NR2F2MEN1KMT2AMAPK1HSD17B10
SCHEMBL12590795 0.68 ALDH1A1 (0.42) TP53MAPTMAPK1LMNATLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756110-B1 7H-PYRROLO[2,3-d]PYRIMIDINE DERIVATIVES, AS WELL AS THEIR THERAPEUTICALLY ACCEPTABLE SALTS, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND PROCESS FOR PRODUCTION THE ACTIVE AGENT SZOLCSANYI JANOS (HU) 2010-03-31 — — EP disclosed
US-20080214583-A1 7H-Pyrrolo[2,3-D]Pyrimidine Derivatives, As Well As Their Therapeutically Acceptable Salts, Pharmaceutical Preparations Containing Them And Process For Production The Active Agent SZOLCSANYI JANOS 2008-09-04 — — US disclosed
EP-1756110-A1 7H-PYRROLO[2,3-d]PYRIMIDINE DERIVATIVES, AS WELL AS THEIR THERAPEUTICALLY ACCEPTABLE SALTS, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND PROCESS FOR PRODUCTION THE ACTIVE AGENT Szolcsanyi, Janos (HU) 2007-02-28 — — EP disclosed
WO-2005105804-A1 7H-PYRROLO[2,3-d]PYRIMIDINE DERIVATIVES, AS WELL AS THEIR THERAPEUTICALLY ACCEPTABLE SALTS, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND PROCESS FOR PRODUCTION THE ACTIVE AGENT SZOLCSANYI JANOS (HU) 2005-11-10 — — 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-20080214583-A1 7H-Pyrrolo[2,3-D]Pyrimidine Derivatives, As Well As Their Therapeutically Acceptable Salts, Pharmaceutical Preparations Containing Them And Process For Production The Active Agent TYMS, DPYD, P2RX7 NR2F2 3851/4885MEN1 4329/4885KMT2A 4357/4885

“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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