SCHEMBL1965415

SCHEMBL1965415

CC(C)(C)OC(=O)N(Cc1c(F)cccc1F)n1cccc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.36
RIPK1 Q13546 2/20 0.36
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM1A O60341 1/20 0.33
SSTR4 P31391 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
RORC P51449 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL1964210 0.86 RIPK1 (0.46) GPR119RIPK1KDM4EALDH1A1SMN1; SMN2
SCHEMBL1966131 0.81 KDM1A (0.42) RIPK1KDM1AHDAC3HDAC1HDAC2
SCHEMBL1965544 0.81 RIPK1 (0.47) GPR119RIPK1ALDH1A1SMN1; SMN2CTSS
SCHEMBL1964518 0.80 RIPK1 (0.46) RIPK1RORC
SCHEMBL1966228 0.79 MEN1 (0.41) KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1
SCHEMBL1964950 0.79 AKT1 (0.46) RIPK1HDAC3HDAC1HDAC2NCOR2
SCHEMBL12454614 0.79 RIPK1 (0.46) RIPK1KDM4EALDH1A1SMN1; SMN2
SCHEMBL1964559 0.76 LMNA (0.44) KDM4EALDH1A1RORCGAA
SCHEMBL1966223 0.76 ALDH1A1 (0.42) KDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL1966140 0.76 NPC1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334682-B1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN INC (US) 2017-10-04 EP disclosed
US-8217043-B2 Compounds and methods for their use FIBROGEN, INC. (US) 2012-07-10 US disclosed
EP-2334682-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS Fibrogen, Inc. (US) 2011-06-22 EP disclosed
WO-2010022240-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN, INC. (US) 2010-02-25 WO disclosed
US-20100047367-A1 COMPOUNDS AND METHODS FOR THEIR USE FIBROGEN, INC. 2010-02-25 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-20100047367-A1 COMPOUNDS AND METHODS FOR THEIR USE HIF1AN, HIF1A, EGLN3 GPR119 1429/4885RIPK1 3787/4885KDM4E 471/4885

“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.