SCHEMBL10248342

SCHEMBL10248342

CC(C)CCCn1nnc2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 9/20 0.69
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
MAPT P10636 1/20 0.55
GLA P06280 1/20 0.54
TSHR P16473 1/20 0.54
EGLN3 Q9H6Z9 2/20 0.53
APAF1 O14727 1/20 0.52
POLB P06746 1/20 0.52
P2RX7 Q99572 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
GRM2 Q14416 1/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KEAP1 Q14145 1/20 0.49

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
SCHEMBL16522426 0.95 SLC9A1 (0.69) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL18373283 0.90 SLC9A1 (0.67) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL11959511 0.86 SLC9A1 (0.68) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL14796568 0.84 SLC9A1 (0.79) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL16669010 0.82 SLC9A1 (0.67) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL16668506 0.82 SLC9A1 (0.67) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL16668516 0.82 SLC9A1 (0.67) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL1834794 0.81 SLC9A1 (1.00) SLC9A1RAB9ANPC1MAPTGLA
SCHEMBL5858856 0.81 TSHR (0.55) SLC9A1TSHRAPAF1POLBMEN1
SCHEMBL2346310 0.80 SLC9A1 (0.97) SLC9A1RAB9ANPC1MAPTGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220068509-A1 ELECTRON AND ION CYCLOTRON RESONANCE ENABLED FUSION REACTORS Alpha Ring International, Ltd. (KY) 2022-03-03 US disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
US-8691836-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2014-04-08 US disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 US disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 US disclosed
US-7589067-B2 6, 11-bridged tricyclic macrolides ENANTA PHARMACEUTICALS, INC. (US) 2009-09-15 US disclosed
US-20080039406-A1 3,6-BRIDGED TYLOSIN DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2008-02-14 US disclosed
US-20070082853-A1 6, 11-bridged tricyclic macrolides ENANTA PHARMACEUTICAL, INC. 2007-04-12 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 (4 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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 SLC9A1 2306/4885RAB9A 2363/4885NPC1 2462/4885
US-20070082853-A1 6, 11-bridged tricyclic macrolides CYP2B6, CYP2D6, ABCB11 SLC9A1 1345/4885RAB9A 1907/4885NPC1 53/4885
US-20080039406-A1 3,6-BRIDGED TYLOSIN DERIVATIVES ABCB11, ABCB1, CYP2B6 SLC9A1 2207/4885RAB9A 3390/4885NPC1 91/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 SLC9A1 2306/4885RAB9A 2363/4885NPC1 2462/4885

“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.