SCHEMBL99676

SCHEMBL99676

Cc1cc2c(C(=O)CCl)ccnc2n1OCC[Si](C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 12/20 0.37
▸ GAA P10253 2/20 0.37
▸ MAPT P10636 10/20 0.34
▸ HTT P42858 6/20 0.34
▸ MITF O75030 6/20 0.34
▸ LMNA P02545 6/20 0.34
▸ SMN1; SMN2 Q16637 5/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ HKDC1 Q2TB90 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ RAB9A P51151 4/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ TAAR1 Q96RJ0 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ NUDT1 P36639 1/20 0.30

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
SCHEMBL99873 0.74 — —
SCHEMBL99611 0.73 MAPT (0.36) ALDH1A1GAAMAPTNPC1
SCHEMBL2186138 0.68 ALDH1A1 (0.30) ALDH1A1LMNA
SCHEMBL100858 0.68 — —
SCHEMBL21251037 0.67 CDC7 (0.30) —
SCHEMBL15970561 0.65 JAK2 (0.33) —
SCHEMBL31347135 0.65 MAPT (0.42) ALDH1A1MAPTLMNAPOLBKDM4E
SCHEMBL2184103 0.64 JAK2 (0.35) —
SCHEMBL15646250 0.63 KDM4E (0.36) LMNAKDM4ENUDT1
SCHEMBL5668816 0.62 MAPT (0.43) ALDH1A1MAPTMITFLMNASMN1; SMN2

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
EP-2426129-A1 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors Incyte Corporation (US) 2012-03-07 — — EP disclosed
Send feedback