SCHEMBL11308286

SCHEMBL11308286

CN(CCN(CCCl)c1ccccc1)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 1/20 0.51
▸ PRMT6 Q96LA8 1/20 0.51
▸ PRMT8 Q9NR22 1/20 0.51
▸ EGFR P00533 1/20 0.50
▸ ERBB2 P04626 1/20 0.50
▸ CNR2 P34972 2/20 0.49
▸ TSHR P16473 4/20 0.49
▸ SIGMAR1 Q99720 4/20 0.47
▸ CYP2C19 P33261 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ MAOB P27338 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ PYCR1 P32322 1/20 0.42
▸ TMEM97 Q5BJF2 2/20 0.41
▸ BLM P54132 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 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
SCHEMBL2001215 0.84 CARM1 (0.64) CARM1PRMT6PRMT8TSHRSIGMAR1
SCHEMBL11306090 0.83 TSHR (0.67) CARM1PRMT6PRMT8CNR2TSHR
Hydrochloric Acid SCHEMBL11109064 0.82 CARM1 (0.62) CARM1PRMT6PRMT8TSHRSIGMAR1
Hydrochloric Acid SCHEMBL394643 0.82 CARM1 (0.62) CARM1PRMT6PRMT8TSHRSIGMAR1
SCHEMBL11690263 0.82 TSHR (0.59) EGFRERBB2CNR2TSHRCYP2C19
SCHEMBL11315356 0.81 TSHR (0.50) CARM1PRMT6PRMT8TSHRSIGMAR1
SCHEMBL11411350 0.80 EGFR (0.57) EGFRERBB2CNR2TSHRALDH1A1
SCHEMBL121635 0.80 EGFR (0.58) EGFRERBB2CNR2TSHRALDH1A1
SCHEMBL7055109 0.80 CARM1 (0.75) CARM1PRMT6PRMT8TSHRSIGMAR1
SCHEMBL2058653 0.77 SIGMAR1 (0.65) CARM1PRMT6PRMT8TSHRSIGMAR1

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-4268439-A Basic azo dyestuffs having benzylammoniumamine substituent in the coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-05-19 — — US disclosed
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