SCHEMBL13665348

SCHEMBL13665348

Cc1ccccc1OC=N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
ACHE P22303 1/20 0.41
ALDH1A1 P00352 4/20 0.38
GLA P06280 1/20 0.38
CYP1A2 P05177 2/20 0.37
KDM4E B2RXH2 2/20 0.37
AOC2 O75106 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
SCN4A P35499 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36

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
SCHEMBL534786 0.78 TSHR (0.45) TSHRSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL96749 0.76 TSHR (0.44) TSHRSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL194092 0.76 TSHR (0.43) TSHRSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL3021083 0.76 CA1 (0.62) TSHRSMN1; SMN2KMT2AALDH1A1CYP1A2
SCHEMBL12301112 0.74 TSHR (0.42) TSHRSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL22207361 0.74 TSHR (0.42) TSHRSMN1; SMN2MEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL28454112 0.74 CA1 (0.59) TSHRSMN1; SMN2ALDH1A1CYP1A2KDM4E
SCHEMBL12853863 0.73 KMT2A (0.41) TSHRSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL5535600 0.73 SCN4A (0.42) TSHRSMN1; SMN2MEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL28937033 0.73 CA1 (0.56) TSHRSMN1; SMN2KMT2AALDH1A1CYP1A2

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-20160207905-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF BLUEPRINT MEDICINES CORPORATION 2016-07-21 US disclosed
US-20150067940-A1 PBO Fibers with Improved Mechanical Properties when Exposed to High Temperatures and High Relative Humidity BATTELLE MEMORIAL INSTITUTE (US) 2015-03-12 US disclosed
US-20140231756-A1 PHOSPHORESCENT COMPOUND WITH FUSED RNG SUBSTITUTION UNIVERSAL DISPLAY CORPORATION (US) 2014-08-21 US disclosed
US-8637516-B2 Compounds and compositions as TRK inhibitors IRM LLC (BM) 2014-01-28 US disclosed
EP-1847532-B1 IGF-1R INHIBITOR KYOWA HAKKO KIRIN CO LTD (JP) 2013-06-05 EP disclosed
US-7605272-B2 IGF-1R inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-10-20 US disclosed
US-20090054508-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-26 US disclosed
EP-1790649-A1 Substituted bicyclic pyrimidone derivatives Sanofi-Aventis (FR) 2007-05-30 EP 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-20160207905-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF TYMP, EGFR, TK1 TSHR 2314/4885SMN1; SMN2 3022/4885MEN1 4787/4885
US-20090054508-A1 IGF-1R INHIBITOR IGF1R, IGFBP5, IGFBP1 TSHR 61/4885SMN1; SMN2 3100/4885MEN1 1830/4885

“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.