SCHEMBL7344848

SCHEMBL7344848

CCCN(CCC)Cc1ccccc1P(=NC(=O)O)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 2/20 0.39
▸ HTR1A P08908 1/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ HDAC9 Q9UKV0 1/20 0.35
▸ HDAC5 Q9UQL6 1/20 0.35
▸ TP53 P04637 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ BCHE P06276 3/20 0.34

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
SCHEMBL7350255 0.90 TSHR (0.39) MEN1KMT2ALMNATSHRBCHE
SCHEMBL7346734 0.84 MAPT (0.39) TSHRALDH1A1
SCHEMBL7352882 0.77 POLB (0.36) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL7322208 0.72 CA2 (0.33) MEN1KMT2ANPSR1TSHR
SCHEMBL7344165 0.71 MEN1 (0.45) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL11795231 0.71 HTR1A (0.53) HTR1ALMNATSHRBCHEALDH1A1
SCHEMBL362355 0.71 CA2 (0.44) MEN1KMT2ANPSR1TSHRALDH1A1
SCHEMBL7349941 0.70 KMT2A (0.47) MEN1KMT2ATSHRALDH1A1
SCHEMBL7331788 0.69 CA2 (0.33) MEN1KMT2ANPSR1TSHR
SCHEMBL7331335 0.69 KMT2A (0.48) MEN1KMT2ALMNATP53TSHR

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-4892885-A CARDIOTONICS, DIURETICS AMERICAN CYANAMID COMPANY 1990-01-09 — — US disclosed
Send feedback