SCHEMBL18149867

SCHEMBL18149867

O=C(CS)NCc1cccc(Br)c1F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ MAPT P10636 1/20 0.40
▸ RIPK1 Q13546 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ P2RX7 Q99572 8/20 0.39
▸ HPGD P15428 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CFD P00746 4/20 0.36

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
SCHEMBL2035298 0.78 RIPK1 (0.49) KMT2ANPC1RAB9ARIPK1P2RX7
SCHEMBL11704890 0.77 NPC1 (0.47) KMT2ANPC1RAB9AMAPTHPGD
SCHEMBL12719097 0.74 ATM (0.36) KMT2AMAPTRIPK1CA12CA1
SCHEMBL31016094 0.74 CA1 (0.42) KMT2ANPC1RAB9ARIPK1CA12
SCHEMBL30751344 0.74 RPS6KA1 (0.48) KMT2ANPC1RAB9ARIPK1CA12
SCHEMBL7999181 0.74 RPS6KA1 (0.48) KMT2ANPC1RAB9ARIPK1CA12
SCHEMBL7935337 0.71 P2RX7 (0.53) KMT2ANPC1RAB9AP2RX7SMN1; SMN2
SCHEMBL17540640 0.71 CA12 (0.41) KMT2ACA12CA1CA2CA9
SCHEMBL19233952 0.71 TAAR1 (0.46) MAPT
SCHEMBL7933993 0.70 NPC1 (0.68) KMT2ANPC1RAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10160748-B2 Indazolones as modulators of tnf signaling ABBVIE INC. (US) 2018-12-25 — — US disclosed
US-20180086737-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. 2018-03-29 — — US disclosed
EP-3294726-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING AbbVie Inc. (US) 2018-03-21 — — EP disclosed
WO-2016168633-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. (US) 2016-10-20 — — WO disclosed
WO-2016168633-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. (US) 2016-10-20 — — WO disclosed
US-20160304496-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. 2016-10-20 — — US disclosed
US-20160304496-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-20160304496-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING TNF, CD40, TNFRSF1A KMT2A 4824/4885NPC1 2617/4885RAB9A 2080/4885
US-20180086737-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING TNF, CD40, TNFRSF1A KMT2A 4824/4885NPC1 2617/4885RAB9A 2080/4885
US-10160748-B2 Indazolones as modulators of tnf signaling TNF, CD40, TNFRSF1A KMT2A 4824/4885NPC1 2617/4885RAB9A 2080/4885

“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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