SCHEMBL11588568

SCHEMBL11588568

CCC(C)(C)c1cccc(NC(=O)c2ccccc2C)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.63
▸ THRB P10828 2/20 0.63
▸ TP53 P04637 1/20 0.63
▸ RXFP1 Q9HBX9 2/20 0.62
▸ F2R P25116 2/20 0.61
▸ KCNK3 O14649 3/20 0.59
▸ KCNK9 Q9NPC2 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ POLB P06746 4/20 0.58
▸ PKM P14618 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ HPGD P15428 1/20 0.57
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ P2RX1 P51575 2/20 0.51
▸ MAPT P10636 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
SCHEMBL11589499 0.86 SMN1; SMN2 (0.78) SMN1; SMN2THRBTP53RXFP1F2R
SCHEMBL21652307 0.82 KCNK9 (0.65) RXFP1KCNK3KCNK9POLBRAB9A
SCHEMBL12544169 0.82 RXFP1 (0.88) SMN1; SMN2THRBTP53RXFP1KCNK3
SCHEMBL11668137 0.81 KCNK3 (0.84) SMN1; SMN2THRBTP53RXFP1F2R
SCHEMBL12655113 0.79 POLB (0.57) SMN1; SMN2RXFP1ALDH1A1POLBRAB9A
SCHEMBL533767 0.77 KCNK3 (0.81) SMN1; SMN2THRBTP53RXFP1F2R
SCHEMBL16674476 0.77 RXFP1 (0.78) SMN1; SMN2RXFP1KCNK3KCNK9ALDH1A1
SCHEMBL15528828 0.77 RXFP1 (1.00) SMN1; SMN2RXFP1ALDH1A1KMT2AMEN1
SCHEMBL11305192 0.76 KCNK3 (0.70) SMN1; SMN2THRBTP53RXFP1F2R
SCHEMBL882806 0.76 F2R (1.00) SMN1; SMN2F2RKCNK3KCNK9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4123554-A Fungicidal and germicidal benzanilides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1978-10-31 — — US disclosed
US-4069335-A BENZANILIDES, FUNGICIDES KUMIAL CHEMICAL INDUSTRY CO., LTD. (JA) 1978-01-17 — — US disclosed
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