SCHEMBL2338568

SCHEMBL2338568

O=C(NC1CCOCC1)c1ccc2c(c1)ncn2-c1cccc(-c2ccsc2)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.58
TP53 P04637 7/20 0.57
MAPT P10636 4/20 0.57
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NPC1 O15118 1/20 0.45
DRD2 P14416 2/20 0.43
DRD4 P21917 2/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
FGFR1 P11362 1/20 0.43
KMT2A Q03164 1/20 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
SCHEMBL2334565 0.83 HPGD (0.58) HPGDTP53MAPTALDH1A1POLB
SCHEMBL2337743 0.82 HPGD (0.49) HPGDTP53MAPTALDH1A1NPC1
SCHEMBL2341423 0.82 FGFR1 (0.64) HPGDTP53MAPTALDH1A1NPC1
SCHEMBL2334947 0.82 HPGD (0.62) HPGDTP53MAPTALDH1A1POLB
SCHEMBL2341301 0.81 HPGD (0.48) HPGDTP53MAPTALDH1A1POLB
SCHEMBL2339970 0.80 HPGD (0.56) HPGDTP53MAPTFGFR1KMT2A
SCHEMBL2333619 0.79 FGFR1 (0.63) HPGDALDH1A1NPC1THRBFGFR1
SCHEMBL2338905 0.78 HPGD (0.54) HPGDTP53KMT2A
SCHEMBL23675213 0.76 HPGD (0.72) HPGDTP53MAPTALDH1A1POLB
SCHEMBL1379658 0.76 HPGD (0.56) HPGDTP53MAPTALDH1A1POLB

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
EP-1831206-B1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI PHARM INC (US) 2011-08-24 EP claimed
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US claimed
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. 2006-06-01 US claimed
EP-1831206-B1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI PHARM INC (US) 2011-08-24 EP disclosed
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed
US-7419995-B2 N-substituted benzimidazoyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. 2006-06-01 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-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library KIT, CHUK, TNNI3K HPGD 1642/4885TP53 356/4885MAPT 4519/4885

“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.