SCHEMBL4288922

SCHEMBL4288922

[CH2]C(CCc1ccccc1)OCCOc1ccc(C(C)(C)CC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ HIF1A Q16665 4/20 0.53
▸ CYP3A4 P08684 3/20 0.53
▸ LMNA P02545 3/20 0.53
▸ TSHR P16473 3/20 0.53
▸ TDP1 Q9NUW8 3/20 0.53
▸ APAF1 O14727 3/20 0.53
▸ USP2 O75604 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ TP53 P04637 3/20 0.53
▸ MAPT P10636 3/20 0.53
▸ RAD52 P43351 3/20 0.53
▸ ERBB2 P04626 2/20 0.53
▸ FYN P06241 2/20 0.53
▸ CHRM2 P08172 2/20 0.53
▸ CHRM4 P08173 2/20 0.53
▸ CHRM5 P08912 2/20 0.53
▸ ADRA2A P08913 2/20 0.53

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
Hydrochloric Acid SCHEMBL9822937 0.79 SMN1; SMN2 (0.59) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL4450380 0.77 SMN1; SMN2 (0.56) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL4450377 0.76 HIF1A (0.53) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL26657537 0.76 SMN1; SMN2 (0.67) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
Hydrochloric Acid SCHEMBL3685522 0.75 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL14685191 0.75 CYP3A4 (0.64) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
Hydrochloric Acid SCHEMBL2524643 0.74 SMN1; SMN2 (0.64) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL11057809 0.73 SMN1; SMN2 (0.57) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
Hydrochloric Acid SCHEMBL426560 0.73 KMT2A (0.60) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4
SCHEMBL29167471 0.72 CYP3A4 (0.60) SMN1; SMN2MEN1KMT2AHIF1ACYP3A4

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-20090256283-A1 THERMOPLASTIC RESIN COMPOSITION, MATERIAL FOR SUBSTRATE AND FILM FOR SUBSTRATE SEKISUI CHEMICAL CO., LTD. 2009-10-15 — — US disclosed
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