SCHEMBL2226467

SCHEMBL2226467

N=C(N)Nc1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.59
NPC1 O15118 7/20 0.59
PKM P14618 4/20 0.59
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.52
KDM4E B2RXH2 3/20 0.52
HSD17B10 Q99714 2/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
CYP1A2 P05177 1/20 0.51
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
ADORA3 P0DMS8 1/20 0.50

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
Sulfuric Acid SCHEMBL11274227 0.91 RAB9A (0.55) RAB9ANPC1PKMGAASMN1; SMN2
Nitric Acid SCHEMBL30925715 0.88 NPC1 (0.51) RAB9ANPC1PKMGAASMN1; SMN2
Trifluoroacetic Acid SCHEMBL18453970 0.85 KDM4E (0.55) RAB9ANPC1PKMGAASMN1; SMN2
Trifluoroacetic Acid SCHEMBL29544086 0.85 KDM4E (0.55) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL29114633 0.85 RAB9A (0.52) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL27548451 0.79 RAB9A (0.71) RAB9ANPC1PKMSMN1; SMN2KDM4E
SCHEMBL7091557 0.79 RAB9A (0.59) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL4021933 0.79 NPC1 (0.59) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL10793724 0.79 RAB9A (0.59) RAB9ANPC1PKMGAASMN1; SMN2
SCHEMBL525427 0.79 RAB9A (0.61) RAB9ANPC1PKMGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014024193-A1 COMPOSITIONS AND METHODS FOR RAPID TRANSMUCOSAL DELIVERY OF PHARMACEUTICAL INGREDIENTS PRODEL PHARMA LTD. (IL) 2014-02-13 WO claimed
US-20100086495-A1 COMPOSITIONS AND METHODS FOR ENHANCING TRANSMUCOSAL DELIVERY DERMA-YOUNG LTD. (IL) 2010-04-08 US claimed
EP-2114384-A2 COMPOSITIONS AND METHODS FOR ENHANCING TRANSMUCOSAL DELIVERY Derma-Young Ltd. (IL) 2009-11-11 EP claimed
WO-2008099397-A2 COMPOSITIONS AND METHODS FOR ENHANCING TRANSMUCOSAL DELIVERY DERMA-YOUNG LTD. (IL) 2008-08-21 WO claimed
US-7087240-B1 Device and method for the treatment of erectile dysfunction LAVIPHARM LABORATORIES INC. (US) 2006-08-08 US claimed
EP-1089679-B1 A DEVICE AND METHOD FOR THE TREATMENT OF ERECTILE DYSFUNCTION LAVIPHARM LAB INC (US) 2005-09-07 EP claimed
EP-1089679-A1 A DEVICE AND METHOD FOR THE TREATMENT OF ERECTILE DYSFUNCTION Lavipharm Laboratories, Inc. (US) 2001-04-11 EP claimed
WO-1999066870-A1 A DEVICE AND METHOD FOR THE TREATMENT OF ERECTILE DYSFUNCTION LAVIPHARM LABORATORIES, INC. (US) 1999-12-29 WO claimed
CN-114502555-B Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridin-3-yl) pyrimidin-2-amine for the treatment of proliferative diseases and disorders 常州千红生化制药股份有限公司 2024-07-16 CN disclosed
CN-114269742-B Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridinyl) pyrimidin-2-amine as therapeutic agents 常州千红生化制药股份有限公司 2024-07-16 CN disclosed
CN-118307517-A Preparation method of arbeli and intermediate thereof 北京海美源医药科技有限公司 2024-07-09 CN disclosed
US-20240158391-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS AUCENTRA THERAPEUTICS PTY LTD (AU) 2024-05-16 US disclosed
CN-116640238-B Guanidyl pyridine chitosan onium salt and preparation method and application thereof 华侨大学 2024-05-03 CN disclosed
CN-116640238-B Guanidyl pyridine chitosan onium salt and preparation method and application thereof 华侨大学 2024-05-03 CN disclosed
EP-0116628-A4 1-ACYL-3-PYRIDYLMETHYLGUANIDINES AND THEIR USE AS ANTIHYPERTENSIVE AGENTS. RORER INTERNAT OVERSEAS INC (US) 1985-02-18 EP disclosed
US-4496573-A 1-Pyridylmethyl-3-acyl guanidines WILLIAM H. RORER, INC. (US) 1985-01-29 US disclosed
EP-0116628-A1 1-ACYL-3-PYRIDYLMETHYLGUANIDINES AND THEIR USE AS ANTIHYPERTENSIVE AGENTS. RORER INT OVERSEAS (US) 1984-08-29 EP disclosed
WO-1984000963-A1 1-ACYL-3-PYRIDYLGUANIDINES AND THEIR USE AS ANTIHYPERTENSIVE AGENTS RORER INT OVERSEAS (US) 1984-03-15 WO disclosed
US-RE31244-E Antihypertensive pyridylguanidine compounds LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1983-05-17 US disclosed
US-4057636-A Antihypertensive pyridylguanidine compounds LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 1977-11-08 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-20240158391-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS CDK9, CDK4, CDK2 RAB9A 1762/4885NPC1 4571/4885PKM 441/4885

“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.