SCHEMBL9531913

SCHEMBL9531913

CC(=O)c1ccc(N2CCN(c3ccccc3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.68
RAB9A P51151 3/20 0.68
KMT2A Q03164 6/20 0.64
MAPT P10636 5/20 0.64
ALDH1A1 P00352 5/20 0.64
CRHBP P24387 1/20 0.58
HTT P42858 1/20 0.58
CRHR2 Q13324 1/20 0.58
MEN1 O00255 4/20 0.58
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
HPGD P15428 1/20 0.58
ALOX15 P16050 1/20 0.58
TSHR P16473 1/20 0.58
STAT1 P42224 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HSD17B10 Q99714 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
HTR7 P34969 1/20 0.57
POLB P06746 2/20 0.56

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
SCHEMBL15801114 0.92 MAPT (0.71) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL17669252 0.92 MAPT (0.71) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL1481892 0.87 POLB (0.72) KMT2AMAPTALDH1A1CRHBPHTT
SCHEMBL3028108 0.85 MAPT (0.69) NPC1RAB9AKMT2AMAPTALDH1A1
Acetophenone SCHEMBL28757159 0.85 MAPT (0.64) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL336009 0.85 NPC1 (0.65) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL2327169 0.84 DRD4 (0.66) KMT2AMAPTALDH1A1LMNATP53
SCHEMBL1482123 0.84 HTR2A (0.69) KMT2AMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL909633 0.84 MAPT (0.62) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL15156349 0.84 MAPT (0.62) NPC1RAB9AKMT2AMAPTALDH1A1

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
EP-2961743-B1 1-SUBSTITUTED, 4-(SUBSTITUTED PHENOXYMETHYL)-1,2,3-TRIAZOLE COMPOUNDS WITH ANTIFUNGAL PROPERTIES AND METHODS FOR PREPARATION THEREOF FDC LTD (IN) 2018-06-20 EP disclosed
US-7452921-B2 for use in radiation curing; printing inks or varnishes; 4-Piperazinoacetophenone SUN CHEMICAL CORPORATION (US) 2008-11-18 US disclosed
US-7452921-B2 for use in radiation curing; printing inks or varnishes; 4-Piperazinoacetophenone SUN CHEMICAL CORPORATION (US) 2008-11-18 US disclosed
US-20070066700-A1 Piperazine-based sensitisers SUN CHEMICAL CORPORATION 2007-03-22 US disclosed
US-20070066700-A1 Piperazine-based sensitisers SUN CHEMICAL CORPORATION 2007-03-22 US disclosed
EP-0250193-B1 Photoreactive lenses MARCONI GEC LTD (GB) 1993-10-27 EP disclosed
US-4818096-A SUNGLASSES; BENZO OR NAPHTHOPYRANS WITH NITROGEN CONTAINING SUBSTITUENTS THE PLESSEY COMPANY PLC (GB) 1989-04-04 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-20070066700-A1 Piperazine-based sensitisers H1-4, H1-5, EP300 NPC1 2729/4885RAB9A 4563/4885KMT2A 120/4885

“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.