SCHEMBL7691906

SCHEMBL7691906

Cc1ccc(C)c(OCc2ccccc2CC(N)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ CYP2C9 P11712 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.43
▸ TTR P02766 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C8 P10632 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ HTR2B P41595 1/20 0.43

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
SCHEMBL8200023 0.89 PTGDR2 (0.50) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL7788740 0.87 TSHR (0.56) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8197488 0.86 TSHR (0.48) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8421443 0.85 PTGER1 (0.54) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8592978 0.85 SMN1; SMN2 (0.54) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL28334171 0.85 SMN1; SMN2 (0.52) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL7784387 0.84 SMN1; SMN2 (0.51) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL27486882 0.84 TSHR (0.49) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL13794084 0.84 KDM4E (0.51) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8197491 0.82 PTGDR2 (0.48) PTGDR2ALDH1A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3672411-A1 MULTI-COMPONENT, SOIL-APPLIED, PESTICIDAL COMPOSITIONS Vive Crop Protection Inc. (CA) 2020-07-01 — — EP disclosed
WO-2019038642-A1 MULTI-COMPONENT, SOIL-APPLIED, PESTICIDAL COMPOSITIONS VIVE CROP PROTECTION INC. (CA) 2019-02-28 — — WO disclosed
US-6344472-B1 SYNERGISTIC RHONE-POULENC, INC. 2002-02-05 — — US disclosed
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