SCHEMBL8683353

SCHEMBL8683353

CC(N)COc1ccc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ LMNA P02545 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ SLC2A1 P11166 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ NLRP1 Q9C000 1/20 0.48
▸ SCN4A P35499 2/20 0.48
▸ TSHR P16473 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ KDM1A O60341 1/20 0.47
▸ MRGPRX4 Q96LA9 1/20 0.46
▸ S1PR4 O95977 1/20 0.46
▸ MAPT P10636 1/20 0.45

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
SCHEMBL8683356 1.00 SMN1; SMN2 (0.51) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL9967704 0.85 KDM1A (0.56) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL8605474 0.84 SCN4A (0.66) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL14578182 0.83 PTGER1 (0.48) CYP1A2CYP2D6SCN4AKDM1AMAPT
SCHEMBL5034472 0.82 SMN1; SMN2 (0.51) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL11595834 0.82 CYP1A2 (0.56) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL16454997 0.81 SCN4A (0.50) LMNACYP1A2CYP2D6SCN4ATSHR
SCHEMBL11592951 0.79 LMNA (0.57) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL16595730 0.79 LMNA (0.49) SMN1; SMN2LMNACYP1A2CYP2D6TDP1
SCHEMBL21325145 0.78 MEN1 (0.49) LMNACYP1A2CYP2D6TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113513-A1 QUINOLINE DERIVATIVES AS FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-05-06 — — US disclosed
US-20100113513-A1 QUINOLINE DERIVATIVES AS FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-05-06 — — US disclosed
WO-2008110355-A1 QUINOLINE DERIVATIVES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-09-18 — — WO disclosed
US-5811424-A CONTROL OF DOWNY MILDEW, LATE BLIGHT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1998-09-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100113513-A1 QUINOLINE DERIVATIVES AS FUNGICIDES CYP1A1, CYP4X1, CYP3A7 SMN1; SMN2 3466/4885LMNA 4157/4885CYP1A2 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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