SCHEMBL1702074

SCHEMBL1702074

Cc1cc(OC(F)(F)F)ccc1Nc1ccc2ccccc2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
RAB9A P51151 3/20 0.50
GAA P10253 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
ACP1 P24666 1/20 0.49
P2RX7 Q99572 6/20 0.45
HTT P42858 1/20 0.44
PIK3CA P42336 1/20 0.42
PRKDC P78527 1/20 0.42
SLC2A1 P11166 1/20 0.42
NCF1 P14598 1/20 0.42
IGF1R P08069 1/20 0.40
DHFR P00374 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL27143795 0.84 P2RX7 (0.43) GAAP2RX7PIK3CAPRKDCDHFR
SCHEMBL21617089 0.84 SMN1; SMN2 (0.47) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL30764791 0.84 SMN1; SMN2 (0.47) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL1702482 0.84 PIK3CA (0.51) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL1702147 0.82 MAPT (0.46) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL30764804 0.82 SMN1; SMN2 (0.45) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL21617054 0.82 SMN1; SMN2 (0.45) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL21617062 0.82 ACP1 (0.51) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL30764793 0.82 ACP1 (0.51) NPC1SMN1; SMN2RAB9AGAAKDM4E
SCHEMBL30764788 0.81 P2RX7 (0.42) P2RX7PIK3CAPRKDCDHFR

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 139 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440546-B1 COMPOUNDS USEFUL FOR TREATING PREMATURE AGING AND IN PARTICULAR PROGERIA ABIVAX (FR) 2022-12-28 EP claimed
EP-2440547-B1 New chemical molecules that inhibit the splicing mechanism for the treatment of diseases resulting from splicing defects ABIVAX (FR) 2022-11-30 EP claimed
EP-3517534-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2019-07-31 EP claimed
US-10017498-B2 Compounds useful for treating AIDS ABIVAX (FR) 2018-07-10 US claimed
US-9827237-B2 Compounds useful for treating diseases caused by retroviruses ABIVAX (FR) 2017-11-28 US claimed
US-20160151348-A1 COMPOUNDS USEFUL FOR TREATING DISEASES CAUSED BY RETROVIRUSES ABIVAX (FR) 2016-06-02 US claimed
EP-3016656-A1 BICYCLIC COMPOUNDS USEFUL FOR TREATING DISEASES CAUSED BY RETROVIRUSES ABIVAX (FR) 2016-05-11 EP claimed
CN-105530938-A Compounds for the treatment of diseases caused by retroviruses ABIVAX 2016-04-27 CN claimed
US-20150307478-A1 COMPOUNDS USEFUL FOR TREATING AIDS UNIVERSITE DE MONTPELLIER (FR) 2015-10-29 US claimed
CN-104945378-A Compounds for the treatment of premature aging and especially premature aging ABIVAX 2015-09-30 CN claimed
US-20120329796-A1 COMPOUNDS USEFUL FOR TREATING PREMATURE AGING AND IN PARTICULAR PROGERIA SOCIETE SPLICOS (FR) 2012-12-27 US claimed
US-20120283265-A1 COMPOUNDS USEFUL FOR TREATING AIDS SOCIETE SPLICOS (FR) 2012-11-08 US claimed
US-20120277230-A1 COMPOUNDS USEFUL FOR TREATING CANCER SOCIETE SPLICOS (FR) 2012-11-01 US claimed
CN-102625804-A Compounds for the treatment of AIDS SPLICOS SOC 2012-08-01 CN claimed
CN-102596935-A Compounds for the treatment of premature aging and especially premature aging SPLICOS SOC 2012-07-18 CN claimed
CN-102574835-A Compounds for the treatment of cancer SPLICOS SOC 2012-07-11 CN claimed
EP-2440545-A2 COMPOUNDS USEFUL FOR TREATING CANCER Société Splicos (FR) 2012-04-18 EP claimed
EP-2440546-A2 COMPOUNDS USEFUL FOR TREATING PREMATURE AGING AND IN PARTICULAR PROGERIA Société Splicos (FR) 2012-04-18 EP claimed
WO-2010143168-A2 COMPOUNDS USEFUL FOR TREATING CANCER SOCIÉTÉ SPLICOS (FR) 2010-12-16 WO claimed
WO-2010143170-A2 COMPOUNDS USEFUL FOR TREATING PREMATURE AGING AND IN PARTICULAR PROGERIA SOCIÉTÉ SPLICOS (FR) 2010-12-16 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-10017498-B2 Compounds useful for treating AIDS NR1H3, NR1H2, NR1H4 NPC1 7/4885SMN1; SMN2 4057/4885RAB9A 1953/4885
US-20120283265-A1 COMPOUNDS USEFUL FOR TREATING AIDS CBR1, CNR1, CBR3 NPC1 45/4885SMN1; SMN2 4559/4885RAB9A 4149/4885
US-20120277230-A1 COMPOUNDS USEFUL FOR TREATING CANCER CBR1, CBR3, NCOR1 NPC1 129/4885SMN1; SMN2 4495/4885RAB9A 4050/4885
US-20120329796-A1 COMPOUNDS USEFUL FOR TREATING PREMATURE AGING AND IN PARTICULAR PROGERIA NR2C2, NCOR2, NR4A2 NPC1 144/4885SMN1; SMN2 1391/4885RAB9A 4270/4885
US-20150307478-A1 COMPOUNDS USEFUL FOR TREATING AIDS NR1H3, NR1H2, NR1H4 NPC1 7/4885SMN1; SMN2 4057/4885RAB9A 1953/4885
US-20160151348-A1 COMPOUNDS USEFUL FOR TREATING DISEASES CAUSED BY RETROVIRUSES RCOR1, CBR1, RCOR3 NPC1 126/4885SMN1; SMN2 2094/4885RAB9A 3396/4885

“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.