SCHEMBL18851067

SCHEMBL18851067

O=C(Cc1ccc(Cl)cc1)Nc1nc2ccc(Br)cc2s1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 11/20 0.71
▸ MAPT P10636 3/20 0.69
▸ LMNA P02545 1/20 0.69
▸ RAB9A P51151 3/20 0.60
▸ NPC1 O15118 2/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ DYRK1A Q13627 1/20 0.60
▸ ALDH1A1 P00352 2/20 0.57
▸ CLK1 P49759 2/20 0.57
▸ TP53 P04637 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ MEN1 O00255 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ HTT P42858 1/20 0.55

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
SCHEMBL16896899 0.83 CSNK1D (0.67) CSNK1DMAPTLMNARAB9ANPC1
SCHEMBL17287787 0.83 CSNK1D (1.00) CSNK1DRAB9ANPC1CYP3A4SMN1; SMN2
SCHEMBL17287735 0.83 CSNK1D (1.00) CSNK1DDYRK1A
SCHEMBL30849479 0.82 RAB9A (0.68) CSNK1DMAPTLMNARAB9ANPC1
SCHEMBL27173184 0.82 RAB9A (0.68) CSNK1DMAPTLMNARAB9ANPC1
SCHEMBL21552791 0.82 KMT2A (0.69) CSNK1DMAPTRAB9ANPC1DYRK1A
SCHEMBL16299055 0.81 CSNK1D (1.00) CSNK1DMAPTLMNARAB9ANPC1
SCHEMBL17287759 0.81 CSNK1D (0.88) CSNK1DCYP3A4WNT3A
SCHEMBL29093283 0.80 RAB9A (0.65) CSNK1DMAPTLMNARAB9ANPC1
SCHEMBL30595109 0.80 RAB9A (0.65) CSNK1DMAPTLMNARAB9ANPC1

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-20180312493-A1 Antibiotic Compounds, Pharmaceutical Formulations Thereof And Methods And Uses Therefor CENTRE FOR DRUG RESEARCH AND DEVELOPMENT (CA) 2018-11-01 — — US disclosed
WO-2017075694-A1 ANTIBIOTIC COMPOUNDS, PHARMACEUTICAL FORMULATIONS THEREOF AND METHODS AND USES THEREFOR SIMON FRASER UNIVERSITY (CA) 2017-05-11 — — WO 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-20180312493-A1 Antibiotic Compounds, Pharmaceutical Formulations Thereof And Methods And Uses Therefor UGT1A8, CYP2C8, CXCL8 CSNK1D 3437/4885MAPT 3944/4885LMNA 1975/4885

“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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