SCHEMBL1163482

SCHEMBL1163482

CCCn1cc(CCNCc2cccc(C)n2)c2c(O)c(F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
HTR2B P41595 1/20 0.34
POLB P06746 2/20 0.33
SLC40A1 Q9NP59 1/20 0.33
ICMT O60725 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
THRB P10828 1/20 0.31
MPO P05164 2/20 0.31
TAAR1 Q96RJ0 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
MAPK1 P28482 1/20 0.30
P2RX7 Q99572 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL1163141 0.88 SMN1; SMN2 (0.46) SMN1; SMN2HTR2AHTR2CHTR2BPOLB
SCHEMBL1163480 0.78 HTR2A (0.44) HTR2AHTR2CHTR2BPOLBICMT
SCHEMBL17943811 0.76 HTR2A (0.41) HTR2AHTR2CHTR2BICMTCNR1
SCHEMBL3804482 0.70 HTR2C (0.57) HTR2AHTR2CHTR2BICMTTAAR1
SCHEMBL1163000 0.68 MPO (0.48) MEN1KMT2ATHRBMPOTAAR1
SCHEMBL22564633 0.67 SMN1; SMN2 (0.64) SMN1; SMN2SLC40A1MEN1KMT2AP2RX7
SCHEMBL1163142 0.66 HTR2C (0.46) HTR2AHTR2CHTR2BPOLBMEN1
SCHEMBL9777407 0.64 SMN1; SMN2 (0.68) SMN1; SMN2SLC40A1MEN1KMT2AP2RX7
SCHEMBL21986550 0.64 SMN1; SMN2 (0.59) SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL2258317 0.64 SMN1; SMN2 (0.62) SMN1; SMN2SLC40A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US claimed
EP-2464227-A1 COMPOUNDS AND METHODS OF USE THEREOF Galenea Corporation (US) 2012-06-20 EP claimed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US claimed
WO-2011019738-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2011-02-17 WO claimed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
EP-2464227-A1 COMPOUNDS AND METHODS OF USE THEREOF Galenea Corporation (US) 2012-06-20 EP disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
WO-2011019738-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2011-02-17 WO disclosed
WO-2011019738-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2011-02-17 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 (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-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT SMN1; SMN2 1404/4885HTR2A 34/4885HTR2C 27/4885
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT SMN1; SMN2 1404/4885HTR2A 34/4885HTR2C 27/4885
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT SMN1; SMN2 1404/4885HTR2A 34/4885HTR2C 27/4885

“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.