SCHEMBL22956490

SCHEMBL22956490

C=C(CCNC(=O)COc1ccc(Cl)cn1)NC(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2D6 P10635 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ S1PR3 Q99500 4/20 0.38
▸ S1PR1 P21453 3/20 0.38
▸ S1PR4 O95977 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX15 P16050 1/20 0.38

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
SCHEMBL23182505 0.81 MEN1 (0.51) HTTKMT2ATDP1NPC1CYP1A2
SCHEMBL22627562 0.81 ALDH1A1 (0.44) HPGDPOLBHTTKMT2ATDP1
SCHEMBL22627852 0.78 TRPV1 (0.43) KMT2ATDP1EPHX2
SCHEMBL23182489 0.76 KMT2A (0.47) HTTKMT2ATDP1MAPTNPC1
SCHEMBL22628364 0.76 MAOB (0.46) KMT2ATDP1NPC1RAB9A
SCHEMBL23182495 0.76 TDP1 (0.54) HTTKMT2ATDP1NPC1CYP1A2
SCHEMBL22956487 0.75 ATF4 (0.50) HPGDMAPTNPC1TP53CYP1A2
SCHEMBL25808564 0.75 TDP1 (0.52) HTTKMT2ATDP1NPC1TP53
SCHEMBL25808242 0.74 GRIN1 (0.47) HTTKMT2ACYP1A2CYP2C19SMN1; SMN2
SCHEMBL25796969 0.74 TDP1 (0.43) HPGDKMT2ATDP1

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-10913727-B2 Modulators of the integrated stress pathway ABBVIE INC. (US) 2021-02-09 — — 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-10913727-B2 Modulators of the integrated stress pathway ATF4, ATF1, DDIT3 HPGD 849/4885POLB 1764/4885HTT 2496/4885

“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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