SCHEMBL16826434

SCHEMBL16826434

COc1ccc(CNC(=O)C2CCN(c3nc(N)n[nH]3)CC2)c(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.59
▸ ALDH1A1 P00352 5/20 0.52
▸ RXFP1 Q9HBX9 2/20 0.52
▸ HPGD P15428 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ PTBP1 P26599 1/20 0.49
▸ EPHX2 P34913 2/20 0.48
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47

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
SCHEMBL18135561 0.91 POLB (0.60) MAPTALDH1A1RXFP1POLBTSHR
SCHEMBL16825942 0.88 POLB (0.63) MAPTALDH1A1HPGDPOLBTSHR
SCHEMBL16826124 0.86 TDP1 (0.67) MAPTALDH1A1POLBTSHRSMN1; SMN2
SCHEMBL16825726 0.79 LMNA (0.52) MAPTRXFP1KDM4EPOLBSMN1; SMN2
SCHEMBL23576456 0.79 ALDH1A1 (0.61) MAPTALDH1A1RXFP1HPGDTSHR
SCHEMBL32671561 0.79 ALDH1A1 (0.61) MAPTALDH1A1RXFP1HPGDTSHR
SCHEMBL16825929 0.78 KDM4E (0.57) MAPTALDH1A1RXFP1HPGDKDM4E
SCHEMBL18135560 0.77 LMNA (0.43) MAPTALDH1A1RXFP1HPGDKDM4E
SCHEMBL16826017 0.77 KDM4E (0.46) MAPTALDH1A1RXFP1KDM4EPOLB
SCHEMBL16825684 0.77 KDM4E (0.61) MAPTALDH1A1RXFP1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3082805-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME The Institute For Drug Delivery (US) 2016-10-26 — — EP claimed
US-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INSTITUTE FOR DRUG DISCOVERY, LLC 2016-10-13 — — US claimed
WO-2015095701-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME THE INSTITUTE FOR DRUG DELIVERY (US) 2015-06-25 — — WO claimed
EP-3082805-B1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INST FOR DRUG DISCOVERY LLC (US) 2020-02-05 — — EP disclosed
EP-3082805-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME The Institute For Drug Delivery (US) 2016-10-26 — — EP disclosed
US-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INSTITUTE FOR DRUG DISCOVERY, LLC 2016-10-13 — — US disclosed
US-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME INSTITUTE FOR DRUG DISCOVERY, LLC 2016-10-13 — — US disclosed
WO-2015095701-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME THE INSTITUTE FOR DRUG DELIVERY (US) 2015-06-25 — — 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-20160297823-A1 SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME CMA1, CHIA, AADAC MAPT 2060/4885ALDH1A1 1006/4885RXFP1 2473/4885

“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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