SCHEMBL352615

SCHEMBL352615

COc1cccc(Nc2nc3ncnc-3c(NC3CC4CCC3C4)[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 2/20 0.40
EGFR P00533 5/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
PDGFRA P16234 4/20 0.37
PDGFRB P09619 3/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37

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
SCHEMBL351991 0.91 ALDH1A1 (0.35) PDE9AALDH1A1POLBPDGFRAPDGFRB
SCHEMBL351556 0.88 ADORA2A (0.37) EGFRPOLBPDGFRAPDGFRBRAB9A
SCHEMBL350165 0.82 TNNI3K (0.38) ADORA3ADORA1ADORA2AGPR183
SCHEMBL351023 0.76 ADORA3 (0.45) MAPTHTTSMN1; SMN2ADORA3ADORA1
SCHEMBL370217 0.76 ADORA3 (0.34) ADORA3ADORA1ADORA2AGPR183
SCHEMBL1306599 0.75 ALK (0.49)
SCHEMBL4412618 0.74 EGFR (0.49) PDE9AEGFRMEN1KMT2AMAPT
SCHEMBL10171936 0.70 ADORA3 (0.55) EGFRNPC1RAB9ALMNAHTT
SCHEMBL352724 0.68 SYK (0.37) EGFRPDGFRAPDGFRBDYRK3MAP4K4
SCHEMBL1306926 0.67 IRAK4 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960372-B1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2015-12-09 EP claimed
EP-1960372-A1 KINASE INHIBITORS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2008-08-27 EP claimed
WO-2007070872-A1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 WO claimed
US-20070142402-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 US claimed
US-9834568-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20160024116-A1 Kinase Inhibitors And Their Uses MIDCAP FINANCIAL TRUST 2016-01-28 US disclosed
EP-1960372-B1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2015-12-09 EP disclosed
US-9096542-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2015-08-04 US disclosed
US-20120015937-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-8053434-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2011-11-08 US disclosed
US-20100069369-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2010-03-18 US disclosed
US-7601713-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2009-10-13 US disclosed
US-20070142402-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 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 (4 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-20120015937-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN PDE9A 1043/4885EGFR 362/4885MEN1 2835/4885
US-20160024116-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN PDE9A 1043/4885EGFR 362/4885MEN1 2835/4885
US-20100069369-A1 Kinase Inhibitors And Their Uses BTK, SYK, JAK2 PDE9A 697/4885EGFR 262/4885MEN1 3297/4885
US-20070142402-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN PDE9A 1043/4885EGFR 362/4885MEN1 2835/4885

“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.