SCHEMBL9469072

SCHEMBL9469072

COc1ccc2[nH]c(-c3ccccc3N)cc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.64
MAPT P10636 3/20 0.64
RAB9A P51151 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
NPC1 O15118 2/20 0.64
AURKA O14965 1/20 0.54
KDR P35968 1/20 0.54
ITK Q08881 2/20 0.53
AXL P30530 1/20 0.51
CA2 P00918 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA9 Q16790 1/20 0.51
LOXL2 Q9Y4K0 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL9469075 0.82 KDM4E (0.61) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL6118322 0.82 RAB9A (0.64) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL903536 0.82 FLT3 (0.53) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL28763455 0.80 KDM4E (0.57) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL6303491 0.80 KDM4E (0.61) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL7066063 0.79 MEN1 (0.59) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL1429201 0.78 NPC1 (1.00) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL25175575 0.78 KDM4E (0.62) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL29361867 0.77 KDR (0.58) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL221259 0.77 KDR (0.58) KDM4EMAPTRAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5166170-A 2-(AMINOARYL) INDOLES AND INDOLINES AS TOPICAL ANTIINFLAMMATORY AGENTS FOR THE TREATMENT OF SKIN DISORDERS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-11-24 US claimed
US-5214059-A Dermatitis, psoriasis HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-25 US disclosed
US-5166170-A 2-(AMINOARYL) INDOLES AND INDOLINES AS TOPICAL ANTIINFLAMMATORY AGENTS FOR THE TREATMENT OF SKIN DISORDERS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-11-24 US disclosed
EP-0406734-A2 2-(Aminoaryl)indoles and indolines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-09 EP disclosed