SCHEMBL27761684

SCHEMBL27761684

CC1COCC1Oc1nccc(-c2cccnc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.46
▸ PTK2 Q05397 1/20 0.46
▸ ABL1 P00519 6/20 0.41
▸ PRKCA P17252 3/20 0.41
▸ PRKCD Q05655 3/20 0.41
▸ EGFR P00533 2/20 0.41
▸ CYP2A6 P11509 4/20 0.40
▸ PRKD3 O94806 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PRKCB P05771 1/20 0.40
▸ LCK P06239 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCI P41743 1/20 0.40
▸ ZAP70 P43403 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCZ Q05513 1/20 0.40
▸ PRKD1 Q15139 1/20 0.40
▸ NPC1 O15118 3/20 0.40

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
SCHEMBL27761682 0.78 KDM4E (0.41) HSP90AA1NPC1RAB9A
SCHEMBL18615439 0.73 HSP90AA1 (0.50) HSP90AA1HSP90AB1PTK2ABL1PRKCA
Hydrochloric Acid SCHEMBL20357284 0.72 HSP90AA1 (0.49) HSP90AA1HSP90AB1PTK2ABL1PRKCA
Hydrochloric Acid SCHEMBL20357283 0.72 HSP90AA1 (0.49) HSP90AA1HSP90AB1PTK2ABL1PRKCA
SCHEMBL18615680 0.71 CKS1B (0.46) ABL1RAB9ABCRDUSP10SRC
SCHEMBL20357315 0.68 ABL1 (0.43) HSP90AA1HSP90AB1PTK2ABL1PRKCA
SCHEMBL28739390 0.68 HSP90AA1 (0.56) HSP90AA1HSP90AB1PTK2ABL1PRKCA
SCHEMBL10917422 0.68 HSP90AA1 (0.60) HSP90AA1HSP90AB1PTK2ABL1PRKCA
SCHEMBL10817967 0.67 HSP90AA1 (0.64) HSP90AA1HSP90AB1PTK2ABL1PRKCA
SCHEMBL27991965 0.67 ABL1 (0.52) HSP90AA1HSP90AB1PTK2ABL1PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101417995-A Phenoxy pyrimidine derivates and its production and use YIJUN CHEN (CN) 2009-04-29 — — CN disclosed
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