SCHEMBL11874157

SCHEMBL11874157

Cc1cc2ncc3nnnn3c2cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ POLB P06746 2/20 0.35
▸ CUL4A Q13619 1/20 0.33
▸ ADORA3 P0DMS8 3/20 0.33
▸ ADORA1 P30542 3/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ CHEK1 O14757 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ CLK4 Q9HAZ1 1/20 0.32
▸ GPR55 Q9Y2T6 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ TP53 P04637 2/20 0.31
▸ KCNH2 Q12809 1/20 0.30
▸ HRH4 Q9H3N8 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
SCHEMBL11864169 0.87 ALDH1A1 (0.40) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11874915 0.87 CUL4A (0.36) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11874188 0.79 MAPT (0.32) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11867415 0.75 NOTUM (0.37) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11875487 0.75 ADORA3 (0.56) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11868175 0.75 GAA (0.45) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11868525 0.75 CHEK1 (0.58) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11868935 0.75 ADORA3 (0.56) MAPTALDH1A1KDM4EMAPK1HTT
SCHEMBL11872864 0.74 KDM4E (0.32) MAPTALDH1A1KDM4EHTTCUL4A
SCHEMBL11869822 0.73 SMN1; SMN2 (0.35) MAPTALDH1A1KDM4EMAPK1HTT

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
US-3987196-A FUNGISTATS ELI LILLY AND COMPANY (US) 1976-10-19 — — US disclosed
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