SCHEMBL18145874

SCHEMBL18145874

C=CCC(Br)c1cc(C#N)ccc1OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 3/20 0.40
▸ SLC6A4 P31645 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARD Q03181 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ PRKDC P78527 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ICMT O60725 2/20 0.35
▸ KDM1A O60341 1/20 0.34
▸ CTSA P10619 1/20 0.34
▸ PDE5A O76074 2/20 0.33
▸ GUSB P08236 1/20 0.33
▸ ESRRA P11474 1/20 0.33
▸ TRPV4 Q9HBA0 1/20 0.33

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
SCHEMBL16952367 0.78 AR (0.44) ARSLC6A4ALDH1A1KDM1ACTSA
SCHEMBL16955918 0.74 AR (0.46) ARSLC6A4ALDH1A1ICMTKDM1A
SCHEMBL523615 0.74 AR (0.49) ARSLC6A4ALDH1A1ICMTKDM1A
SCHEMBL9918204 0.72 AR (0.42) ARSLC6A4ALDH1A1ICMTKDM1A
SCHEMBL16962581 0.72 AR (0.42) ARSLC6A4ALDH1A1PPARGPPARD
SCHEMBL17731548 0.72 AR (0.47) ARSLC6A4ALDH1A1KDM1ACTSA
SCHEMBL17731549 0.72 AR (0.47) ARSLC6A4ALDH1A1KDM1ACTSA
SCHEMBL18146257 0.72 IMPDH2 (0.33) MAPT
SCHEMBL171796 0.72 AR (0.47) ARSLC6A4ALDH1A1ICMTKDM1A
SCHEMBL18923587 0.72 AR (0.44) ARSLC6A4ICMTKDM1ACTSA

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-10273238-B2 Indazolones as modulators of TNF signaling ABBVIE INC. (US) 2019-04-30 — — US disclosed
US-20180215764-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. 2018-08-02 — — US disclosed
US-9879016-B2 Indazolones as modulators of TNF signaling ABBVIE INC. (US) 2018-01-30 — — US disclosed
US-20160304526-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. 2016-10-20 — — 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 (3 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-20180215764-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING TNF, TNFRSF9, TNFRSF1A AR 1021/4885SLC6A4 1905/4885ALDH1A1 930/4885
US-20160304526-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING TNF, TNFRSF9, TNFRSF1A AR 1021/4885SLC6A4 1905/4885ALDH1A1 930/4885
US-10273238-B2 Indazolones as modulators of TNF signaling TNF, TNFRSF9, TNFRSF1A AR 1021/4885SLC6A4 1905/4885ALDH1A1 930/4885

“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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