SCHEMBL3757098

SCHEMBL3757098

NC(=O)c1ccccc1OCc1ccccn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 1/20 0.60
▸ PARP1 P09874 2/20 0.57
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ NR1I2 O75469 1/20 0.54
▸ CHRM2 P08172 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ ADRA2A P08913 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ OPRK1 P41145 1/20 0.54
▸ HTR2B P41595 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.54
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ HTT P42858 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ AURKA O14965 1/20 0.49
▸ RPS6KB1 P23443 1/20 0.49

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
SCHEMBL2447492 0.86 ALDH1A1 (0.55) PARP10KMT2ALMNANPC1RAB9A
SCHEMBL16418410 0.85 CTSD (0.58) PARP10MEN1KMT2ALMNANPC1
Hydrochloric Acid SCHEMBL27796957 0.83 NPC1 (0.48) PARP10KMT2ALMNACYP3A4MAPT
SCHEMBL718082 0.77 PARP1 (0.79) PARP10PARP1MEN1KMT2ALMNA
SCHEMBL1425730 0.77 PARP1 (0.52) PARP1MEN1KMT2ALMNANR1I2
SCHEMBL28030524 0.77 NPC1 (0.57) PARP1MEN1KMT2ALMNANR1I2
SCHEMBL5485714 0.76 PARP10 (0.65) PARP10CYP3A4KDM4ESMN1; SMN2
SCHEMBL14879637 0.76 HTT (0.68) PARP1MEN1KMT2ALMNANR1I2
SCHEMBL27537822 0.76 MAPT (0.62) PARP1MEN1KMT2ALMNANR1I2
SCHEMBL16498156 0.76 SYK (0.56) KMT2ARAB9AKDM4EABCB1HTR1A

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-20100311748-A1 HETEROCYCLIC AMIDES USEFUL FOR THE TREATMENT OF CANCER AND PSORIASIS ASTRAZENECA AB (SE) 2010-12-09 — — US disclosed
CN-101835752-A Heterocyclic amides useful for the treatment of cancer and psoriasis ASTRAZENECA AB 2010-09-15 — — CN 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-20100311748-A1 HETEROCYCLIC AMIDES USEFUL FOR THE TREATMENT OF CANCER AND PSORIASIS SHH, GLI1, HRH4 PARP10 2432/4885PARP1 3460/4885MEN1 1499/4885

“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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